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Proto-oncogene tyrosine-protein kinase ros (ROS1)

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  1. Gilteritinib, Tyrosine-protein kinase receptor UFO inhibitor
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    Gilteritinib, Tyrosine-protein kinase receptor UFO inhibitor
    CAS: 1254053-43-4 EC Number: 107-777-6 Formula: C29H44N8O3 Molecular Weight: 552.7115
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥97%
    In Stock Item #: G172979
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    IUPAC Name
    6-ethyl-3-[3-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]anilino]-5-(oxan-4-ylamino)pyrazine-2-carboxamide
    SMILES
    CCC1=C(N=C(C(=N1)C(=O)N)NC2=CC(=C(C=C2)N3CCC(CC3)N4CCN(CC4)C)OC)NC5CCOCC5
    InChIKey
    GYQYAJJFPNQOOW-UHFFFAOYSA-N
    InChI
    1S/C29H44N8O3/c1-4-23-28(31-20-9-17-40-18-10-20)34-29(26(33-23)27(30)38)32-21-5-6-24(25(19-21)39-3)37-11-7-22(8-12-37)36-15-13-35(2)14-16-36/h5-6,19-2show more
    Synonyms
    GILTERITINIB [WHO-DD] | Gilteritinib HCl | NCGC00481652-01 | AS-35199 | GILTERITINIB [MI] | 1,4-Oxadiazole, 2-(o-hydr...
  2. PF-562271, Inhibitor of aurora kinase A;Inhibitor of fms related receptor tyrosine kinase 3;Inhibitor of protein tyrosine kinase 2;Inhibitor of protein tyrosine kinase 2 beta
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    PF-562271, Inhibitor of aurora kinase A;Inhibitor of fms related receptor tyrosine kinase 3;Inhibitor of protein tyrosine kinase 2;Inhibitor of protein tyrosine kinase 2 beta
    CAS: 717907-75-0 Formula: C21H20F3N7O3S Molecular Weight: 507.49
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    In Stock Item #: P126147
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    IUPAC Name
    N-methyl-N-[3-[[[2-[(2-oxo-1,3-dihydroindol-5-yl)amino]-5-(trifluoromethyl)pyrimidin-4-yl]amino]methyl]pyridin-2-yl]methanesulfonamide
    SMILES
    CN(C1=C(C=CC=N1)CNC2=NC(=NC=C2C(F)(F)F)NC3=CC4=C(C=C3)NC(=O)C4)S(=O)(=O)C
    InChIKey
    MZDKLVOWGIOKTN-UHFFFAOYSA-N
    InChI
    1S/C21H20F3N7O3S/c1-31(35(2,33)34)19-12(4-3-7-25-19)10-26-18-15(21(22,23)24)11-27-20(30-18)28-14-5-6-16-13(8-14)9-17(32)29-16/h3-8,11H,9-10H2,1-2H3,(Hshow more
    Synonyms
    CHEBI:91370 | EX-A1385 | Q27163236 | HMS3265N12 | HMS3651D06 | Kinome_3857 | TS-01949 | 717907-75-0 (free base) | HMS...
  3. VX-745, MAP kinase p38 alpha inhibitor
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    VX-745, MAP kinase p38 alpha inhibitor
    CAS: 209410-46-8 EC Number: 187-765-5 PubChem CID: 3038525 Formula: C19H9Cl2F2N3OS Molecular Weight: 436.27
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    In Stock Item #: V126681
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    IUPAC Name
    5-(2,6-dichlorophenyl)-2-(2,4-difluorophenyl)sulfanylpyrimido[1,6-b]pyridazin-6-one
    SMILES
    C1=CC(=C(C(=C1)Cl)C2=C3C=CC(=NN3C=NC2=O)SC4=C(C=C(C=C4)F)F)Cl
    InChIKey
    VEPKQEUBKLEPRA-UHFFFAOYSA-N
    InChI
    1S/C19H9Cl2F2N3OS/c20-11-2-1-3-12(21)17(11)18-14-5-7-16(25-26(14)9-24-19(18)27)28-15-6-4-10(22)8-13(15)23/h1-9H
    Synonyms
    BCPP000015 | s1458 | BRD-K91900765-001-01-9 | Kinome_3767 | 5-(2,6-dichlorophenyl)-2-[(2,4-difluorophenyl)thio]pyrimi...
  4. LDK378, NPM/ALK (Nucleophosmin/ALK tyrosine kinase receptor)
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    LDK378, NPM/ALK (Nucleophosmin/ALK tyrosine kinase receptor)
    CAS: 1032900-25-6 EC Number: 811-457-8 Formula: C28H36ClN5O3S Molecular Weight: 558.14
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥99%
    In Stock Item #: L127618
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    IUPAC Name
    5-chloro-2-N-(5-methyl-4-piperidin-4-yl-2-propan-2-yloxyphenyl)-4-N-(2-propan-2-ylsulfonylphenyl)pyrimidine-2,4-diamine
    SMILES
    CC1=CC(=C(C=C1C2CCNCC2)OC(C)C)NC3=NC=C(C(=N3)NC4=CC=CC=C4S(=O)(=O)C(C)C)Cl
    InChIKey
    VERWOWGGCGHDQE-UHFFFAOYSA-N
    InChI
    1S/C28H36ClN5O3S/c1-17(2)37-25-15-21(20-10-12-30-13-11-20)19(5)14-24(25)33-28-31-16-22(29)27(34-28)32-23-8-6-7-9-26(23)38(35,36)18(3)4/h6-9,14-18,20,3show more
    Synonyms
    K418KG2GET | 5-chloro-2-N-[5-methyl-4-(piperidin-4-yl)-2-(propan-2-yloxy)phenyl]-4-N-[2-(propane-2-sulfonyl)phenyl]py...
  5. AP26113
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    AP26113
    CAS: 1197958-12-5 Formula: C26H34ClN6O2P Molecular Weight: 529.01
    ≥98%
    In Stock Item #: A127691
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    IUPAC Name
    5-chloro-2-N-[4-[4-(dimethylamino)piperidin-1-yl]-2-methoxyphenyl]-4-N-(2-dimethylphosphorylphenyl)pyrimidine-2,4-diamine
    SMILES
    CN(C)C1CCN(CC1)C2=CC(=C(C=C2)NC3=NC=C(C(=N3)NC4=CC=CC=C4P(=O)(C)C)Cl)OC
    InChIKey
    OVDSPTSBIQCAIN-UHFFFAOYSA-N
    InChI
    1S/C26H34ClN6O2P/c1-32(2)18-12-14-33(15-13-18)19-10-11-21(23(16-19)35-3)30-26-28-17-20(27)25(31-26)29-22-8-6-7-9-24(22)36(4,5)34/h6-11,16-18H,12-15H2,show more
    Synonyms
    5-Chloro-N2-[4-[4-(dimethylamino)-1-piperidinyl]-2-methoxyphenyl]-N4-[2-(dimethylphosphinyl)phenyl]-2,4-pyrimidinedia...
  6. ASP3026, ALK tyrosine kinase receptor inhibitor
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    ASP3026, ALK tyrosine kinase receptor inhibitor
    CAS: 1097917-15-1 Formula: C29H40N8O3S Molecular Weight: 580.74
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    In Stock Item #: A128022
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    IUPAC Name
    2-N-[2-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]-4-N-(2-propan-2-ylsulfonylphenyl)-1,3,5-triazine-2,4-diamine
    SMILES
    CC(C)S(=O)(=O)C1=CC=CC=C1NC2=NC(=NC=N2)NC3=C(C=C(C=C3)N4CCC(CC4)N5CCN(CC5)C)OC
    InChIKey
    MGGBYMDAPCCKCT-UHFFFAOYSA-N
    InChI
    1S/C29H40N8O3S/c1-21(2)41(38,39)27-8-6-5-7-25(27)33-29-31-20-30-28(34-29)32-24-10-9-23(19-26(24)40-4)36-13-11-22(12-14-36)37-17-15-35(3)16-18-37/h5-10show more
    Synonyms
    F6O | SMR004702945 | UNII-HP4L6MXF10 | XTB91715 | NCGC00345791-01 | N2-(2-(isopropylsulfonyl)phenyl)-N4-(2-methoxy-4-...
  7. R1530, Inhibitor of aurora kinase A;Inhibitor of fms related receptor tyrosine kinase 1;Inhibitor of fms related receptor tyrosine kinase 3;Inhibitor of Janus kinase 2;Inhibitor of kinase insert domain receptor;Inhibitor of KIT proto-oncogene; receptor tyrosine
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    R1530, Inhibitor of aurora kinase A;Inhibitor of fms related receptor tyrosine kinase 1;Inhibitor of fms related receptor tyrosine kinase 3;Inhibitor of Janus kinase 2;Inhibitor of kinase insert domain receptor;Inhibitor of KIT proto-oncogene; receptor tyrosine
    CAS: 882531-87-5 EC Number: 809-817-4 PubChem CID: 135398512 Formula: C18H14ClFN4O Molecular Weight: 356.78
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    In Stock Item #: R127879
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    IUPAC Name
    5-(2-chlorophenyl)-7-fluoro-8-methoxy-3-methyl-2,10-dihydropyrazolo[3,4-b][1,4]benzodiazepine
    SMILES
    CC1=C2C(=NN1)NC3=CC(=C(C=C3C(=N2)C4=CC=CC=C4Cl)F)OC
    InChIKey
    UOVCGJXDGOGOCZ-UHFFFAOYSA-N
    InChI
    1S/C18H14ClFN4O/c1-9-16-18(24-23-9)21-14-8-15(25-2)13(20)7-11(14)17(22-16)10-5-3-4-6-12(10)19/h3-8H,1-2H3,(H2,21,23,24)
    Synonyms
    EX-A2311 | NSC767953 | NSC-767953 | UNII-XQJ55R5PPQ | 5-(2-Chlorophenyl)-7-fluoro-8-methoxy-3-methyl-1,2-dihydrobenzo...
  8. Entrectinib, ALK tyrosine kinase receptor inhibitor
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    Entrectinib, ALK tyrosine kinase receptor inhibitor
    CAS: 1108743-60-7 EC Number: 816-298-8 Formula: C31H34F2N6O2 Molecular Weight: 560.64
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    In Stock Item #: E302199
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    IUPAC Name
    N-[5-[(3,5-difluorophenyl)methyl]-1H-indazol-3-yl]-4-(4-methylpiperazin-1-yl)-2-(oxan-4-ylamino)benzamide
    SMILES
    CN1CCN(CC1)C2=CC(=C(C=C2)C(=O)NC3=NNC4=C3C=C(C=C4)CC5=CC(=CC(=C5)F)F)NC6CCOCC6
    InChIKey
    HAYYBYPASCDWEQ-UHFFFAOYSA-N
    InChI
    1S/C31H34F2N6O2/c1-38-8-10-39(11-9-38)25-3-4-26(29(19-25)34-24-6-12-41-13-7-24)31(40)35-30-27-17-20(2-5-28(27)36-37-30)14-21-15-22(32)18-23(33)16-21/hshow more
    Synonyms
    DB11986 | RXDX 101 | ENTRECTINIB [WHO-DD] | RG 6268 | NCGC00484067-01 | NCGC00484067-02 | NSC774769 | NSC-774769 | N-...
  9. TAE684 (NVP-TAE684), Inhibitor of ALK receptor tyrosine kinase
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    TAE684 (NVP-TAE684), Inhibitor of ALK receptor tyrosine kinase
    CAS: 761439-42-3 PubChem CID: 16038120 Formula: C30H40ClN7O3S Molecular Weight: 614.2
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    In Stock Item #: T129819
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    IUPAC Name
    5-chloro-2-N-[2-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]-4-N-(2-propan-2-ylsulfonylphenyl)pyrimidine-2,4-diamine
    SMILES
    CC(C)S(=O)(=O)C1=CC=CC=C1NC2=NC(=NC=C2Cl)NC3=C(C=C(C=C3)N4CCC(CC4)N5CCN(CC5)C)OC
    InChIKey
    QQWUGDVOUVUTOY-UHFFFAOYSA-N
    InChI
    1S/C30H40ClN7O3S/c1-21(2)42(39,40)28-8-6-5-7-26(28)33-29-24(31)20-32-30(35-29)34-25-10-9-23(19-27(25)41-4)37-13-11-22(12-14-37)38-17-15-36(3)16-18-38/show more
    Synonyms
    5-chloro-N2-[2-methoxy-4-[4-(4-methyl-1-pyperidinyl]-N4-[2-[(1-methylethyl)sulfonyl]phenyl]-2,4-Pyrimidinediamine | 5...
  10. Lorlatinib - Moligand™, ≥98%(HPLC) CAS No(1454846-35-5) P167337 by Aladdin Scientific
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    Lorlatinib, EML4-ALK inhibitor
    CAS: 1454846-35-5 EC Number: 813-704-5 PubChem CID: 71731823 Formula: C21H19FN6O2 Molecular Weight: 406.41
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%(HPLC)
    In Stock Item #: P167337
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    IUPAC Name
    (16R)-19-amino-13-fluoro-4,8,16-trimethyl-9-oxo-17-oxa-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carshow more
    SMILES
    CC1C2=C(C=CC(=C2)F)C(=O)N(CC3=NN(C(=C3C4=CC(=C(N=C4)N)O1)C#N)C)C
    InChIKey
    IIXWYSCJSQVBQM-LLVKDONJSA-N
    InChI
    1S/C21H19FN6O2/c1-11-15-7-13(22)4-5-14(15)21(29)27(2)10-16-19(17(8-23)28(3)26-16)12-6-18(30-11)20(24)25-9-12/h4-7,9,11H,10H2,1-3H3,(H2,24,25)/t11-/m1/show more
    Synonyms
    (10R)-7-Amino-12-fluoro-2,10,16-trimethyl-15-oxo-10,15,16,17-tetrahydro-2H-4,8-methenopyrazolo(4,3-h)(2,5,11)benzoxad...
  11. AP26113-analog (ALK-IN-1)
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    AP26113-analog (ALK-IN-1)
    CAS: 1197958-12-5 Formula: C26H34ClN6O2P Molecular Weight: 529.01
    10mM in DMSO
    In Stock Item #: A408626
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    Technical Identifiers
    Synonyms
    2,4-Pyrimidinediamine, 5-chloro-N2-[4-[4-(dimethylamino)-1-piperidinyl]-2-methoxyphenyl]-N4-[2-(dimethylphosphinyl)ph...
  12. ASP3026, ALK tyrosine kinase receptor inhibitor
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    ASP3026, ALK tyrosine kinase receptor inhibitor
    CAS: 1097917-15-1 Formula: C29H40N8O3S Molecular Weight: 580.74
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. 10mM in DMSO
    In Stock Item #: A420576
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    Technical Identifiers
    IUPAC Name
    2-N-[2-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]-4-N-(2-propan-2-ylsulfonylphenyl)-1,3,5-triazine-2,4-diamine
    SMILES
    CC(C)S(=O)(=O)C1=CC=CC=C1NC2=NC(=NC=N2)NC3=C(C=C(C=C3)N4CCC(CC4)N5CCN(CC5)C)OC
    InChIKey
    MGGBYMDAPCCKCT-UHFFFAOYSA-N
    InChI
    1S/C29H40N8O3S/c1-21(2)41(38,39)27-8-6-5-7-25(27)33-29-31-20-30-28(34-29)32-24-10-9-23(19-26(24)40-4)36-13-11-22(12-14-36)37-17-15-35(3)16-18-37/h5-10show more
    Synonyms
    F6O | SMR004702945 | UNII-HP4L6MXF10 | XTB91715 | NCGC00345791-01 | N2-(2-(isopropylsulfonyl)phenyl)-N4-(2-methoxy-4-...
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