Reaction Details |
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Target | Poly [ADP-ribose] polymerase 2 |
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Ligand | BDBM50315779 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_626085 (CHEMBL1110690) |
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Ki | 1.5±n/a nM |
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Citation | Penning, TD; Zhu, GD; Gong, J; Thomas, S; Gandhi, VB; Liu, X; Shi, Y; Klinghofer, V; Johnson, EF; Park, CH; Fry, EH; Donawho, CK; Frost, DJ; Buchanan, FG; Bukofzer, GT; Rodriguez, LE; Bontcheva-Diaz, V; Bouska, JJ; Osterling, DJ; Olson, AM; Marsh, KC; Luo, Y; Giranda, VL Optimization of phenyl-substituted benzimidazole carboxamide poly(ADP-ribose) polymerase inhibitors: identification of (S)-2-(2-fluoro-4-(pyrrolidin-2-yl)phenyl)-1H-benzimidazole-4-carboxamide (A-966492), a highly potent and efficacious inhibitor. J Med Chem53:3142-53 (2010) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Poly [ADP-ribose] polymerase 2 |
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Name: | Poly [ADP-ribose] polymerase 2 |
Synonyms: | (ARTD2 or PARP2) | ADPRT2 | ADPRTL2 | PARP2 | PARP2_HUMAN | Poly [ADP-ribose] polymerase 2 (PARP-2) | Poly [ADP-ribose] polymerase 2 (PARP2) |
Type: | Enzyme |
Mol. Mass.: | 66225.70 |
Organism: | Homo sapiens (Human) |
Description: | Q9UGN5 |
Residue: | 583 |
Sequence: | MAARRRRSTGGGRARALNESKRVNNGNTAPEDSSPAKKTRRCQRQESKKMPVAGGKANKD
RTEDKQDGMPGRSWASKRVSESVKALLLKGKAPVDPECTAKVGKAHVYCEGNDVYDVMLN
QTNLQFNNNKYYLIQLLEDDAQRNFSVWMRWGRVGKMGQHSLVACSGNLNKAKEIFQKKF
LDKTKNNWEDREKFEKVPGKYDMLQMDYATNTQDEEETKKEESLKSPLKPESQLDLRVQE
LIKLICNVQAMEEMMMEMKYNTKKAPLGKLTVAQIKAGYQSLKKIEDCIRAGQHGRALME
ACNEFYTRIPHDFGLRTPPLIRTQKELSEKIQLLEALGDIEIAIKLVKTELQSPEHPLDQ
HYRNLHCALRPLDHESYEFKVISQYLQSTHAPTHSDYTMTLLDLFEVEKDGEKEAFREDL
HNRMLLWHGSRMSNWVGILSHGLRIAPPEAPITGYMFGKGIYFADMSSKSANYCFASRLK
NTGLLLLSEVALGQCNELLEANPKAEGLLQGKHSTKGLGKMAPSSAHFVTLNGSTVPLGP
ASDTGILNPDGYTLNYNEYIVYNPNQVRMRYLLKVQFNFLQLW
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BDBM50315779 |
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n/a |
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Name | BDBM50315779 |
Synonyms: | (S)-2-(2-Fluoro-4-(pyrrolidin-2-yl)phenyl)-1H-benzimidazole-4-carboxamide | CHEMBL1090467 |
Type | Small organic molecule |
Emp. Form. | C18H17FN4O |
Mol. Mass. | 324.3522 |
SMILES | NC(=O)c1cccc2[nH]c(nc12)-c1ccc(cc1F)[C@@H]1CCCN1 |r| |
Structure |
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