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10 Items

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  1. , Receptor protein-tyrosine kinase erbB-4 inhibitor
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    Neratinib (HKI-272), Receptor protein-tyrosine kinase erbB-4 inhibitor
    Cas#: 698387-09-6        Compound CID:  9915743
    Formula:  C30H29ClN6O3        Molecular Weight: 557.04
    IUPAC Name: (E)-N-[4-[3-chloro-4-(pyridin-2-ylmethoxy)anilino]-3-cyano-7-ethoxyquinolin-6-yl]-4-(dimethylamino)but-2-enamide
    SMILES: CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=C(C=C3)OCC4=CC=CC=N4)Cl)C#N)NC(=O)C=CCN(C)C
    InChIKey: JWNPDZNEKVCWMY-VQHVLOKHSA-N
    InChI: InChI=1S/C30H29ClN6O3/c1-4-39-28-16-25-23(15-26(28)36-29(38)9-7-13-37(2)3)30(20(17-32)18-34-25)35-21-10-11-27(24(31)14-21)40-19-22-8-5-6-12-33-22/h5-12,14-16,18H,4,13,19H2,1-3H3,(H,34,35)(H,36,38)/b9-7+
    Synonyms: EC 244-343-6 | N-(4-(3-chloro-4-(pyridin-2-ylmethoxy)phenylamino)-3-cyano-7-ethoxyquinolin-6-yl)-4-(dimethylamino)but...
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  2. , Tyrosine-protein kinase BTK inhibitor
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    Ibrutinib (PCI-32765), Tyrosine-protein kinase BTK inhibitor
    Cas#: 936563-96-1        Compound CID:  24821094
    Formula:  C25H24N6O2        Molecular Weight: 440.5
    IUPAC Name: 1-[(3R)-3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]prop-2-en-1-one
    SMILES: C=CC(=O)N1CCCC(C1)N2C3=NC=NC(=C3C(=N2)C4=CC=C(C=C4)OC5=CC=CC=C5)N
    InChIKey: XYFPWWZEPKGCCK-GOSISDBHSA-N
    InChI: InChI=1S/C25H24N6O2/c1-2-21(32)30-14-6-7-18(15-30)31-25-22(24(26)27-16-28-25)23(29-31)17-10-12-20(13-11-17)33-19-8-4-3-5-9-19/h2-5,8-13,16,18H,1,6-7,14-15H2,(H2,26,27,28)/t18-/m1/s1
    Synonyms: PCI32765 | 1-{(3R)-3-[4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl}prop-2-en-1-one | 1...
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  3. , Inhibitor of epidermal growth factor receptor;Inhibitor of OATP2B1
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    Erlotinib, Inhibitor of epidermal growth factor receptor;Inhibitor of OATP2B1
    Cas#: 183321-74-6        Compound CID:  176870
    Formula:  C22H23N3O4        Molecular Weight: 393.44
    IUPAC Name: N-(3-ethynylphenyl)-6,7-bis(2-methoxyethoxy)quinazolin-4-amine
    SMILES: COCCOC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC=CC(=C3)C#C)OCCOC
    InChIKey: AAKJLRGGTJKAMG-UHFFFAOYSA-N
    InChI: InChI=1S/C22H23N3O4/c1-4-16-6-5-7-17(12-16)25-22-18-13-20(28-10-8-26-2)21(29-11-9-27-3)14-19(18)23-15-24-22/h1,5-7,12-15H,8-11H2,2-3H3,(H,23,24,25)
    Synonyms: R 1415 | Kinome_3317 | n-(3-ethynylphenyl)-6,7-bis(2-methoxyethoxy)-4-quinazolinamine monohydrochloride | Tox21_30121...
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  4. , Tyrosine 3-hydroxylase inhibitor
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    alpha-methyl-L-tyrosine, Tyrosine 3-hydroxylase inhibitor
    Cas#: 672-87-7        Compound CID:  441350
    Formula:  C10H13NO3        Molecular Weight: 195.22
    IUPAC Name: (2S)-2-amino-3-(4-hydroxyphenyl)-2-methylpropanoic acid
    SMILES: CC(CC1=CC=C(C=C1)O)(C(=O)O)N
    InChIKey: NHTGHBARYWONDQ-JTQLQIEISA-N
    InChI: InChI=1S/C10H13NO3/c1-10(11,9(13)14)6-7-2-4-8(12)5-3-7/h2-5,12H,6,11H2,1H3,(H,13,14)/t10-/m0/s1
    Synonyms: DTXCID203315 | Metirosina [INN-Spanish] | Metirosinum | Metyrosine [USAN] | MFCD00064201 | NCGC00094144-03 | s8033 | ...
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    α-Methyl-L-tyrosine
    Cas#: 672-87-7        Compound CID:  441350
    Formula:  C10H13NO3        Molecular Weight: 195.22
    IUPAC Name: (2S)-2-amino-3-(4-hydroxyphenyl)-2-methylpropanoic acid
    SMILES: CC(CC1=CC=C(C=C1)O)(C(=O)O)N
    InChIKey: NHTGHBARYWONDQ-JTQLQIEISA-N
    InChI: InChI=1S/C10H13NO3/c1-10(11,9(13)14)6-7-2-4-8(12)5-3-7/h2-5,12H,6,11H2,1H3,(H,13,14)/t10-/m0/s1
    Synonyms: DTXCID203315 | Metirosina [INN-Spanish] | Metirosinum | Metyrosine [USAN] | MFCD00064201 | NCGC00094144-03 | s8033 | ...
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  6. , Tyrosine-protein kinase BTK inhibitor
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    Acalabrutinib (ACP-196), Tyrosine-protein kinase BTK inhibitor
    Cas#: 1420477-60-6        Compound CID:  71226662
    Formula:  C26H23N7O2        Molecular Weight: 465.51
    IUPAC Name: 4-[8-amino-3-[(2S)-1-but-2-ynoylpyrrolidin-2-yl]imidazo[1,5-a]pyrazin-1-yl]-N-pyridin-2-ylbenzamide
    SMILES: CC#CC(=O)N1CCCC1C2=NC(=C3N2C=CN=C3N)C4=CC=C(C=C4)C(=O)NC5=CC=CC=N5
    InChIKey: WDENQIQQYWYTPO-IBGZPJMESA-N
    InChI: InChI=1S/C26H23N7O2/c1-2-6-21(34)32-15-5-7-19(32)25-31-22(23-24(27)29-14-16-33(23)25)17-9-11-18(12-10-17)26(35)30-20-8-3-4-13-28-20/h3-4,8-14,16,19H,5,7,15H2,1H3,(H2,27,29)(H,28,30,35)/t19-/m0/s1
    Synonyms: BDBM50175583 | Benzamide, 4-[8-amino-3-[(2S)-1-(1-oxo-2-butyn-1-yl)-2-pyrrolidinyl]imidazo[1,5-a]pyrazin-1-yl]-N-2-py...
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  7. , Inhibitor of ALK receptor tyrosine kinase;Inhibitor of MET proto-oncogene; receptor tyrosine kinase
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    CH5424802, Inhibitor of ALK receptor tyrosine kinase;Inhibitor of MET proto-oncogene; receptor tyrosine kinase
    Cas#: 1256580-46-7        Compound CID:  49806720
    Formula:  C30H34N4O2        Molecular Weight: 482.62
    IUPAC Name: 9-ethyl-6,6-dimethyl-8-(4-morpholin-4-ylpiperidin-1-yl)-11-oxo-5H-benzo[b]carbazole-3-carbonitrile
    SMILES: CCC1=CC2=C(C=C1N3CCC(CC3)N4CCOCC4)C(C5=C(C2=O)C6=C(N5)C=C(C=C6)C#N)(C)C
    InChIKey: KDGFLJKFZUIJMX-UHFFFAOYSA-N
    InChI: InChI=1S/C30H34N4O2/c1-4-20-16-23-24(17-26(20)34-9-7-21(8-10-34)33-11-13-36-14-12-33)30(2,3)29-27(28(23)35)22-6-5-19(18-31)15-25(22)32-29/h5-6,15-17,21,32H,4,7-14H2,1-3H3
    Synonyms: Alectinib|1256580-46-7|CH5424802|AF-802|CH 5424802|AF802|RO5424802|UNII-LIJ4CT1Z3Y|Alectinib (CH5424802)|LIJ4CT1Z3Y|C...
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  8. , Inhibitor of ALK receptor tyrosine kinase;Inhibitor of MET proto-oncogene; receptor tyrosine kinase
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    CH5424802, Inhibitor of ALK receptor tyrosine kinase;Inhibitor of MET proto-oncogene; receptor tyrosine kinase
    Cas#: 1256580-46-7        Compound CID:  49806720
    Formula:  C30H34N4O2        Molecular Weight: 482.62
    IUPAC Name: 9-ethyl-6,6-dimethyl-8-(4-morpholin-4-ylpiperidin-1-yl)-11-oxo-5H-benzo[b]carbazole-3-carbonitrile
    SMILES: CCC1=CC2=C(C=C1N3CCC(CC3)N4CCOCC4)C(C5=C(C2=O)C6=C(N5)C=C(C=C6)C#N)(C)C
    InChIKey: KDGFLJKFZUIJMX-UHFFFAOYSA-N
    InChI: InChI=1S/C30H34N4O2/c1-4-20-16-23-24(17-26(20)34-9-7-21(8-10-34)33-11-13-36-14-12-33)30(2,3)29-27(28(23)35)22-6-5-19(18-31)15-25(22)32-29/h5-6,15-17,21,32H,4,7-14H2,1-3H3
    Synonyms: AF 802 | SR-01000389722-2 | 9-ETHYL-6,6-DIMETHYL-8-[4-(MORPHOLIN-4-YL)PIPERIDIN-1-YL]-11-OXO-5H,6H,11H-BENZO[B]CARBAZ...
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  9. , Receptor protein-tyrosine kinase erbB-4 inhibitor
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    Neratinib (HKI-272), Receptor protein-tyrosine kinase erbB-4 inhibitor
    Cas#: 698387-09-6        Compound CID:  9915743
    Formula:  C30H29ClN6O3        Molecular Weight: 557.04
    IUPAC Name: (E)-N-[4-[3-chloro-4-(pyridin-2-ylmethoxy)anilino]-3-cyano-7-ethoxyquinolin-6-yl]-4-(dimethylamino)but-2-enamide
    SMILES: CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=C(C=C3)OCC4=CC=CC=N4)Cl)C#N)NC(=O)C=CCN(C)C
    InChIKey: JWNPDZNEKVCWMY-VQHVLOKHSA-N
    InChI: InChI=1S/C30H29ClN6O3/c1-4-39-28-16-25-23(15-26(28)36-29(38)9-7-13-37(2)3)30(20(17-32)18-34-25)35-21-10-11-27(24(31)14-21)40-19-22-8-5-6-12-33-22/h5-12,14-16,18H,4,13,19H2,1-3H3,(H,34,35)(H,36,38)/b9-7+
    Synonyms: EC 244-343-6 | N-(4-(3-chloro-4-(pyridin-2-ylmethoxy)phenylamino)-3-cyano-7-ethoxyquinolin-6-yl)-4-(dimethylamino)but...
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  10. , Receptor protein-tyrosine kinase erbB-2 inhibitor
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    Tucatinib (Irbinitinib, ONT-380), Receptor protein-tyrosine kinase erbB-2 inhibitor
    Cas#: 937263-43-9        Compound CID:  51039094
    Formula:  C26H24N8O2        Molecular Weight: 480.52
    IUPAC Name: 6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-[3-methyl-4-([1,2,4]triazolo[1,5-a]pyridin-7-yloxy)phenyl]quinazoline-4,6-diamine
    SMILES: CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)NC4=NC(CO4)(C)C)OC5=CC6=NC=NN6C=C5
    InChIKey: SDEAXTCZPQIFQM-UHFFFAOYSA-N
    InChI: InChI=1S/C26H24N8O2/c1-16-10-17(5-7-22(16)36-19-8-9-34-23(12-19)28-15-30-34)31-24-20-11-18(4-6-21(20)27-14-29-24)32-25-33-26(2,3)13-35-25/h4-12,14-15H,13H2,1-3H3,(H,32,33)(H,27,29,31)
    Synonyms: Irbinitinib | ONT-380 | Q25100690 | 6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-[3-methyl-4-([1,2,4]triazolo[1,5-a]pyri...
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  72. CYP2C19 7 items
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  76. TYK2 7 items
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  256. HDAC10 3 items
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  262. OPRD1 3 items
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  264. OPRM1 3 items
  265. KCNA10 3 items
  266. KCNA2 3 items
  267. KCNA5 3 items
  268. KCNA1 3 items
  269. MAP3K20 3 items
  270. CYP2C8 2 items
  271. CYP2J2 2 items
  272. UGCG 2 items
  273. CYP2B6 2 items
  274. GPR17 2 items
  275. ESRRA 2 items
  276. ESRRG 2 items
  277. EPHA4 2 items
  278. EPHA8 2 items
  279. DLK1 2 items
  280. ELANE 2 items
  281. DHFR 2 items
  282. EPHA3 2 items
  283. CACNA1H 2 items
  284. CTSS 2 items
  285. CDK8 2 items
  286. DCLK3 2 items
  287. GBA2 2 items
  288. CYP3A5 2 items
  289. RAF1 2 items
  290. PTK6 2 items
  291. PRTN3 2 items
  292. SLC22A2 2 items
  293. SCN2A 2 items
  294. S1PR2 2 items
  295. SLC12A1 2 items
  296. SLC29A1 2 items
  297. RORB 2 items
  298. STK17A 2 items
  299. STK25 2 items
  300. STK26 2 items
  301. STK33 2 items
  302. SSTR2 2 items
  303. SSTR3 2 items
  304. SSTR5 2 items
  305. TH 2 items
  306. TYMS 2 items
  307. IRAK1 2 items
  308. HRH3 2 items
  309. HDAC4 2 items
  310. HDAC6 2 items
  311. HDAC7 2 items
  312. HDAC11 2 items
  313. HDAC9 2 items
  314. HPD 2 items
  315. CSNK1D 2 items
  316. MERTK 2 items
  317. TSSK1B 2 items
  318. TRPV1 2 items
  319. TNK1 2 items
  320. SIK1 2 items
  321. SIK2 2 items
  322. SF3B3 2 items
  323. SLC47A2 2 items
  324. SLC12A2 2 items
  325. SLC47A1 2 items
  326. TAS2R38 2 items
  327. TAS2R4 2 items
  328. TAS2R46 2 items
  329. TBXAS1 2 items
  330. TEK 2 items
  331. SLCO2B1 2 items
  332. TMEM97 2 items
  333. SIK3 2 items
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  335. TTR 2 items
  336. PKMYT1 2 items
  337. NAPRT 2 items
  338. PIN1 2 items
  339. PHKG1 2 items
  340. PHKG2 2 items
  341. RRM1 2 items
  342. RIPK3 2 items
  343. PTGDR 2 items
  344. PDE10A 2 items
  345. PARP10 2 items
  346. PDE3B 2 items
  347. PTGIR 2 items
  348. PDE1A 2 items
  349. RRM2 2 items
  350. RPS6KA2 2 items
  351. RPS6KA5 2 items
  352. GAA 2 items
  353. LRRK2 2 items
  354. NR1H4 2 items
  355. NR2C2 2 items
  356. CACNA1G 2 items
  357. CACNA1I 2 items
  358. CA13 2 items
  359. CACNA1D 2 items
  360. CACNA1F 2 items
  361. CACNA1S 2 items
  362. CALM1 2 items
  363. BTN3A1 2 items
  364. CYSLTR1 2 items
  365. COMT 2 items
  366. SLC18A1 2 items
  367. GGCX 2 items
  368. CHRNA7 2 items
  369. CHRNA1 2 items
  370. ACOX1 2 items
  371. HSD3B2 2 items
  372. ADA 2 items
  373. AKR1C3 2 items
  374. AHR 2 items
  375. AGTR2 2 items
  376. MAOA 2 items
  377. PRKAA1 2 items
  378. HTR1F 2 items
  379. CHEK2 2 items
  380. SI 2 items
  381. TBXA2R 2 items
  382. ULK1 2 items
  383. ULK2 2 items
  384. TNNI3K 2 items
  385. TRHR 2 items
  386. ASIC3 2 items
  387. CLK2 2 items
  388. GPBAR1 2 items
  389. HDAC8 2 items
  390. HDAC5 2 items
  391. KCNK3 2 items
  392. H1F0 2 items
  393. IMPDH2 2 items
  394. IMPDH1 2 items
  395. ICAM1 2 items
  396. PAK3 2 items
  397. NTRK2 2 items
  398. PPARA 2 items
  399. PPARD 2 items
  400. SLC10A1 2 items
  401. NTRK1 2 items
  402. PPP3CA 2 items
  403. CAMK2G 2 items
  404. KCNT1 2 items
  405. MAPK14 2 items
  406. MAP2K5 2 items
  407. MTNR1A 2 items
  408. NISCH 2 items
  409. MYLK3 2 items
  410. MYLK4 2 items
  411. MYLK 2 items
  412. MTNR1B 2 items
  413. CXCR4 1 item
  414. DDX1 1 item
  415. EPHA1 1 item
  416. EZH2 1 item
  417. PTK2 1 item
  418. FABP1 1 item
  419. PKN1 1 item
  420. RAMP1 1 item
  421. REN 1 item
  422. PDE8A 1 item
  423. PDE9A 1 item
  424. F2R 1 item
  425. SLC46A1 1 item
  426. PDE8B 1 item
  427. PTGDR2 1 item
  428. TPO 1 item
  429. MPO 1 item
  430. PARP12 1 item
  431. PDE7B 1 item
  432. PDCD4 1 item
  433. RIPK1 1 item
  434. MMP7 1 item
  435. KLK3 1 item
  436. MPC2 1 item
  437. NR4A3 1 item
  438. MAP4K2 1 item
  439. MCL1 1 item
  440. ALOX5 1 item
  441. LTA4H 1 item
  442. LTK 1 item
  443. LPAR1 1 item
  444. ALOX15 1 item
  445. MAP4K4 1 item
  446. MAP2K7 1 item
  447. ABCC5 1 item
  448. NR1I2 1 item
  449. MPC1L 1 item
  450. CALCR 1 item
  451. CASR 1 item
  452. CA11 1 item
  453. CALCRL 1 item
  454. BMPR2 1 item
  455. BRDT 1 item
  456. BCL2 1 item
  457. BACE1 1 item
  458. BCL2L1 1 item
  459. ATP1A1 1 item
  460. ATP4A 1 item
  461. BCL2L2 1 item
  462. AURKB 1 item
  463. AURKC 1 item
  464. AVPR2 1 item
  465. TRPM8 1 item
  466. GC 1 item
  467. ACVR1 1 item
  468. CHRNA3 1 item
  469. CHRNA4 1 item
  470. CHRNE 1 item
  471. ABCB11 1 item
  472. ACKR3 1 item
  473. ALOX5AP 1 item
  474. AKR1B10 1 item
  475. AKR1C1 1 item
  476. ANO1 1 item
  477. AKR1B1 1 item
  478. AKR1A1 1 item
  479. TAS2R16 1 item
  480. TAS2R31 1 item
  481. TAS2R9 1 item
  482. TLR7 1 item
  483. CISD1 1 item
  484. ACTR3 1 item
  485. KCTD8 1 item
  486. GRM5 1 item
  487. GSK3A 1 item
  488. GCGR 1 item
  489. ABAT 1 item
  490. GLRB 1 item
  491. GABBR2 1 item
  492. GABBR1 1 item
  493. IDH1 1 item
  494. P2RY12 1 item
  495. P2RX4 1 item
  496. NTRK3 1 item
  497. PPIA 1 item
  498. TACR1 1 item
  499. NQO1 1 item
  500. CAMK2D 1 item
Action Type
  1. INHIBITOR 9 items
Purity
  1. ≥98% 5 items
  2. ≥95% 1 item
  3. ≥96% 1 item
  4. ≥99% 1 item
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