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Assay Detail

CHEMBL1010815

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Binding
Inhibition of human recombinant PARP1
36
Total Activities
36
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Poly [ADP-ribose] polymerase 1 (CHEMBL3105)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery of the Poly(ADP-ribose) polymerase (PARP) inhibitor 2-[(R)-2-methylpyrrolidin-2-yl]-1H-benzimidazole-4-carboxamide (ABT-888) for the treatment of cancer.
Penning TD, Zhu GD, Gandhi VB, Gong J, Liu X, Shi Y, Klinghofer V, Johnson EF, Donawho CK, Frost DJ, Bontcheva-Diaz V, Bouska JJ, Osterling DJ, Olson AM, Marsh KC, Luo Y, Giranda VL.
J Med Chem (2009) 52 : 514 -523
PubMed 19143569 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 36 7.95 8.52

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL521714 1 8.52
CHEMBL495743 1 8.52
CHEMBL525192 1 8.40
CHEMBL495942 1 8.40
CHEMBL526668 1 8.40
CHEMBL488496 1 8.40
CHEMBL521880 1 8.40
CHEMBL506871 VELIPARIB 3.0 1 8.30
CHEMBL497608 1 8.30
CHEMBL498007 1 8.30
CHEMBL521712 1 8.30
CHEMBL488053 1 8.30
CHEMBL527654 1 8.22
CHEMBL497609 1 8.22
CHEMBL495969 1 8.22
CHEMBL498015 1 8.15
CHEMBL488830 1 8.15
CHEMBL495951 1 8.10
CHEMBL506516 1 8.05
CHEMBL498008 1 8.05
CHEMBL450698 1 8.05
CHEMBL496976 1 8.00
CHEMBL522549 1 8.00
CHEMBL507412 1 7.89
CHEMBL495782 1 7.89
CHEMBL504096 1 7.82
CHEMBL525535 1 7.77
CHEMBL445016 1 7.72
CHEMBL497181 1 7.64
CHEMBL495975 1 7.60

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL521714 Ki = 3.0 nM 8.52
CHEMBL495743 Ki = 3.0 nM 8.52
CHEMBL525192 Ki = 4.0 nM 8.40
CHEMBL495942 Ki = 4.0 nM 8.40
CHEMBL526668 Ki = 4.0 nM 8.40
CHEMBL488496 Ki = 4.0 nM 8.40
CHEMBL521880 Ki = 4.0 nM 8.40
CHEMBL521712 Ki = 5.0 nM 8.30
CHEMBL488053 Ki = 5.0 nM 8.30
CHEMBL498007 Ki = 5.0 nM 8.30
CHEMBL497608 Ki = 5.0 nM 8.30
CHEMBL506871 VELIPARIB Ki = 5.0 nM 8.30
CHEMBL527654 Ki = 6.0 nM 8.22
CHEMBL497609 Ki = 6.0 nM 8.22
CHEMBL495969 Ki = 6.0 nM 8.22
CHEMBL498015 Ki = 7.0 nM 8.15
CHEMBL488830 Ki = 7.0 nM 8.15
CHEMBL495951 Ki = 8.0 nM 8.10
CHEMBL506516 Ki = 9.0 nM 8.05
CHEMBL450698 Ki = 9.0 nM 8.05
CHEMBL498008 Ki = 9.0 nM 8.05
CHEMBL496976 Ki = 10.0 nM 8.00
CHEMBL522549 Ki = 10.0 nM 8.00
CHEMBL507412 Ki = 13.0 nM 7.89
CHEMBL495782 Ki = 13.0 nM 7.89
CHEMBL504096 Ki = 15.0 nM 7.82
CHEMBL525535 Ki = 17.0 nM 7.77
CHEMBL445016 Ki = 19.0 nM 7.72
CHEMBL497181 Ki = 23.0 nM 7.64
CHEMBL495975 Ki = 25.0 nM 7.60
CHEMBL488831 Ki = 30.0 nM 7.52
CHEMBL497597 Ki = 31.0 nM 7.51
CHEMBL505909 Ki = 42.0 nM 7.38
CHEMBL523083 Ki = 69.0 nM 7.16
CHEMBL509153 Ki = 130.0 nM 6.89
CHEMBL495950 Ki = 3300.0 nM 5.48