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9 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. , Bcr/Abl fusion protein
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    Dasatinib, Bcr/Abl fusion protein
    Cas#: 302962-49-8        Compound CID:  3062316
    Formula:  C22H26ClN7O2S        Molecular Weight: 488.01
    IUPAC Name: N-(2-chloro-6-methylphenyl)-2-[[6-[4-(2-hydroxyethyl)piperazin-1-yl]-2-methylpyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide
    SMILES: CC1=C(C(=CC=C1)Cl)NC(=O)C2=CN=C(S2)NC3=CC(=NC(=N3)C)N4CCN(CC4)CCO
    InChIKey: ZBNZXTGUTAYRHI-UHFFFAOYSA-N
    InChI: InChI=1S/C22H26ClN7O2S/c1-14-4-3-5-16(23)20(14)28-21(32)17-13-24-22(33-17)27-18-12-19(26-15(2)25-18)30-8-6-29(7-9-30)10-11-31/h3-5,12-13,31H,6-11H2,1-2H3,(H,28,32)(H,24,25,26,27)
    Synonyms: BMS 354825 | AR-270/43507994 | Dasatinib (JAN/INN) | HMS3744C11 | N-(2-CHLORO-6-METHYLPHENYL)-2-({6-[4-(2-HYDROXYETHY...
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  3. , Agonist of Thrombopoietin receptor
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    Eltrombopag, Agonist of Thrombopoietin receptor
    Cas#: 496775-61-2        Compound CID:  135449332
    Formula:  C25H22N4O4        Molecular Weight: 442.47
    IUPAC Name: 3-[3-[[2-(3,4-dimethylphenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]diazenyl]-2-hydroxyphenyl]benzoic acid
    SMILES: CC1=C(C=C(C=C1)N2C(=O)C(=C(N2)C)N=NC3=CC=CC(=C3O)C4=CC(=CC=C4)C(=O)O)C
    InChIKey: SVOQIEJWJCQGDQ-UHFFFAOYSA-N
    InChI: InChI=1S/C25H22N4O4/c1-14-10-11-19(12-15(14)2)29-24(31)22(16(3)28-29)27-26-21-9-5-8-20(23(21)30)17-6-4-7-18(13-17)25(32)33/h4-13,28,30H,1-3H3,(H,32,33)
    Synonyms: BCP9000641 | D02363 | CHEBI:85010 | EN300-1709152 | XDXWLKQMMKQXPV-UHFFFAOYSA-N | SB497115 | SB-497115 | 3'-[(2Z)- [1...
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  4. , Inhibitor of fibroblast growth factor receptor 1;Inhibitor of fms related receptor tyrosine kinase 3;Inhibitor of fms related receptor tyrosine kinase 4;Inhibitor of kinase insert domain receptor;Inhibitor of KIT proto-oncogene; receptor tyrosine kinase;I
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    Sunitinib, Inhibitor of fibroblast growth factor receptor 1;Inhibitor of fms related receptor tyrosine kinase 3;Inhibitor of fms related receptor tyrosine kinase 4;Inhibitor of kinase insert domain receptor;Inhibitor of KIT proto-oncogene; receptor tyrosine kinase;I
    Cas#: 557795-19-4        Compound CID:  5329102
    Formula:  C22H27FN4O2        Molecular Weight: 398.47
    IUPAC Name: N-[2-(diethylamino)ethyl]-5-[(Z)-(5-fluoro-2-oxo-1H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide
    SMILES: CCN(CC)CCNC(=O)C1=C(NC(=C1C)C=C2C3=C(C=CC(=C3)F)NC2=O)C
    InChIKey: WINHZLLDWRZWRT-ATVHPVEESA-N
    InChI: InChI=1S/C22H27FN4O2/c1-5-27(6-2)10-9-24-22(29)20-13(3)19(25-14(20)4)12-17-16-11-15(23)7-8-18(16)26-21(17)28/h7-8,11-12,25H,5-6,9-10H2,1-4H3,(H,24,29)(H,26,28)/b17-12-
    Synonyms: 1H-Pyrrole-3-carboxamide,2-dihydro-2-oxo-3H-indol-3-ylidene)methyl]-2,4-dimethyl- | D08552 | C22H27FN4O2 | N-(2-(Diet...
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  5. , Thrombopoietin receptor agonist
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    lusutrombopag, Thrombopoietin receptor agonist
    Cas#: 1110766-97-6        Compound CID:  49843517
    Formula:  C29H32Cl2N2O5S        Molecular Weight: 591.54
    IUPAC Name: (E)-3-[2,6-dichloro-4-[[4-[3-[(1S)-1-hexoxyethyl]-2-methoxyphenyl]-1,3-thiazol-2-yl]carbamoyl]phenyl]-2-methylprop-2-enoic acid
    SMILES: CCCCCCOC(C)C1=CC=CC(=C1OC)C2=CSC(=N2)NC(=O)C3=CC(=C(C(=C3)Cl)C=C(C)C(=O)O)Cl
    InChIKey: NOZIJMHMKORZBA-KJCUYJGMSA-N
    InChI: InChI=1S/C29H32Cl2N2O5S/c1-5-6-7-8-12-38-18(3)20-10-9-11-21(26(20)37-4)25-16-39-29(32-25)33-27(34)19-14-23(30)22(24(31)15-19)13-17(2)28(35)36/h9-11,13-16,18H,5-8,12H2,1-4H3,(H,35,36)(H,32,33,34)/b17-13+/t18-/m0/s1
    Synonyms: (2E)-3-(2,6-Dichloro-4-((4-(3-((1S)-1-(hexyloxy)ethyl)-2-methoxyphenyl)-1,3-thiazol-2-yl)carbamoyl)phenyl)-2-methylpr...
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  6. , Tyrosine-protein kinase Lyn inhibitor
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    Bosutinib (SKI-606), Tyrosine-protein kinase Lyn inhibitor
    Cas#: 380843-75-4        Compound CID:  5328940
    Formula:  C26H29Cl2N5O3        Molecular Weight: 530.45
    IUPAC Name: 4-(2,4-dichloro-5-methoxyanilino)-6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinoline-3-carbonitrile
    SMILES: CN1CCN(CC1)CCCOC2=C(C=C3C(=C2)N=CC(=C3NC4=CC(=C(C=C4Cl)Cl)OC)C#N)OC
    InChIKey: UBPYILGKFZZVDX-UHFFFAOYSA-N
    InChI: InChI=1S/C26H29Cl2N5O3/c1-32-6-8-33(9-7-32)5-4-10-36-25-13-21-18(11-24(25)35-3)26(17(15-29)16-30-21)31-22-14-23(34-2)20(28)12-19(22)27/h11-14,16H,4-10H2,1-3H3,(H,30,31)
    Synonyms: SKI-606 | WAY-173606 | Bosutinib,SKI-606 | BSPBio_001023 | NCGC00241107-03 | NSC799367 | NSC-799367 | 4-(2,4-Dichloro...
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  7. , 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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  8. , Thrombopoietin receptor agonist
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    lusutrombopag, Thrombopoietin receptor agonist
    Cas#: 1110766-97-6        Compound CID:  49843517
    Formula:  C29H32Cl2N2O5S        Molecular Weight: 591.54
    IUPAC Name: (E)-3-[2,6-dichloro-4-[[4-[3-[(1S)-1-hexoxyethyl]-2-methoxyphenyl]-1,3-thiazol-2-yl]carbamoyl]phenyl]-2-methylprop-2-enoic acid
    SMILES: CCCCCCOC(C)C1=CC=CC(=C1OC)C2=CSC(=N2)NC(=O)C3=CC(=C(C(=C3)Cl)C=C(C)C(=O)O)Cl
    InChIKey: NOZIJMHMKORZBA-KJCUYJGMSA-N
    InChI: InChI=1S/C29H32Cl2N2O5S/c1-5-6-7-8-12-38-18(3)20-10-9-11-21(26(20)37-4)25-16-39-29(32-25)33-27(34)19-14-23(30)22(24(31)15-19)13-17(2)28(35)36/h9-11,13-16,18H,5-8,12H2,1-4H3,(H,35,36)(H,32,33,34)/b17-13+/t18-/m0/s1
    Synonyms: (2E)-3-(2,6-Dichloro-4-((4-(3-((1S)-1-(hexyloxy)ethyl)-2-methoxyphenyl)-1,3-thiazol-2-yl)carbamoyl)phenyl)-2-methylpr...
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    Sunitinib
    Cas#: 557795-19-4        Compound CID:  5329102
    Formula:  C22H27FN4O2        Molecular Weight: 398.47
    IUPAC Name: N-[2-(diethylamino)ethyl]-5-[(Z)-(5-fluoro-2-oxo-1H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide
    SMILES: CCN(CC)CCNC(=O)C1=C(NC(=C1C)C=C2C3=C(C=CC(=C3)F)NC2=O)C
    InChIKey: WINHZLLDWRZWRT-ATVHPVEESA-N
    InChI: InChI=1S/C22H27FN4O2/c1-5-27(6-2)10-9-24-22(29)20-13(3)19(25-14(20)4)12-17-16-11-15(23)7-8-18(16)26-21(17)28/h7-8,11-12,25H,5-6,9-10H2,1-4H3,(H,24,29)(H,26,28)/b17-12-
    Synonyms: 1H-Pyrrole-3-carboxamide,2-dihydro-2-oxo-3H-indol-3-ylidene)methyl]-2,4-dimethyl- | D08552 | C22H27FN4O2 | N-(2-(Diet...
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  270. CYP2C8 2 items
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  290. PTK6 2 items
  291. PRTN3 2 items
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  297. RORB 2 items
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  305. TH 2 items
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  314. HPD 2 items
  315. CSNK1D 2 items
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  318. TRPV1 2 items
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  320. SIK1 2 items
  321. SIK2 2 items
  322. SF3B3 2 items
  323. SLC47A2 2 items
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  326. TAS2R38 2 items
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  337. NAPRT 2 items
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  341. RRM1 2 items
  342. RIPK3 2 items
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  349. RRM2 2 items
  350. RPS6KA2 2 items
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  352. GAA 2 items
  353. LRRK2 2 items
  354. NR1H4 2 items
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  356. CACNA1G 2 items
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  358. CA13 2 items
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  360. CACNA1F 2 items
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  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 5 items
  2. AGONIST 3 items
Molecule Type
  1. Small molecule 8 items
Purity
  1. ≥99% 5 items
  2. ≥97% 2 items
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