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SMILES: NC(=O)c1c2C(=O)N(Cc2ccc1F)C1CCN(CC1)C1CCC(F)(F)CC1

InChI Key: InChIKey=TUJRHEPBGFDNPT-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50110821   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM50110821
PNG
(CHEMBL3606020)
Show SMILES NC(=O)c1c2C(=O)N(Cc2ccc1F)C1CCN(CC1)C1CCC(F)(F)CC1
Show InChI InChI=1S/C20H24F3N3O2/c21-15-2-1-12-11-26(19(28)16(12)17(15)18(24)27)14-5-9-25(10-6-14)13-3-7-20(22,23)8-4-13/h1-2,13-14H,3-11H2,(H2,24,27)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/an/a 1.88E+3n/an/an/an/an/a



Nerviano Medical Sciences Srl

Curated by ChEMBL


Assay Description
Binding affinity to full length recombinant human PARP-1 by fluorescence polarization displacement assay

J Med Chem 58: 6875-98 (2015)


BindingDB Entry DOI: 10.7270/Q2JD4ZKF
More data for this
Ligand-Target Pair