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BDBM50272956 CHEMBL4127063

SMILES: NC(=O)c1ccc(Oc2cccc(c2)C(=O)N2CCC(O)(CC2)c2ccccc2)cc1

InChI Key: InChIKey=OQOIXRCHXMMUEH-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50272956   
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 10


(Homo sapiens (Human))
BDBM50272956
PNG
(CHEMBL4127063)
Show SMILES NC(=O)c1ccc(Oc2cccc(c2)C(=O)N2CCC(O)(CC2)c2ccccc2)cc1
Show InChI InChI=1S/C25H24N2O4/c26-23(28)18-9-11-21(12-10-18)31-22-8-4-5-19(17-22)24(29)27-15-13-25(30,14-16-27)20-6-2-1-3-7-20/h1-12,17,30H,13-16H2,(H2,26,28)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.50E+3n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant His6-tagged human PARP10 expressed in Escherichia coli BL21(DE3) preincubated for 15 mins followed by biotinyla...


Bioorg Med Chem Lett 28: 2050-2054 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.056
BindingDB Entry DOI: 10.7270/Q2RR21R2
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 10


(Homo sapiens (Human))
BDBM50272956
PNG
(CHEMBL4127063)
Show SMILES NC(=O)c1ccc(Oc2cccc(c2)C(=O)N2CCC(O)(CC2)c2ccccc2)cc1
Show InChI InChI=1S/C25H24N2O4/c26-23(28)18-9-11-21(12-10-18)31-22-8-4-5-19(17-22)24(29)27-15-13-25(30,14-16-27)20-6-2-1-3-7-20/h1-12,17,30H,13-16H2,(H2,26,28)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.52E+3n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant His6-tagged human PARP10 expressed in Escherichia coli BL21(DE3) preincubated for 15 mins followed by biotinyla...


Bioorg Med Chem Lett 28: 2050-2054 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.056
BindingDB Entry DOI: 10.7270/Q2RR21R2
More data for this
Ligand-Target Pair