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SMILES: Cc1cc(NCc2c(F)ccc(C)c2Cl)c2cccc(C(N)=O)c2n1

InChI Key: InChIKey=KSZUULRZDQCWCH-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50111153   
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
ADP-ribosyl cyclase/cyclic ADP-ribose hydrolase 1


(Homo sapiens (Human))		BDBM50111153
PNG
(CHEMBL3604740)
Show SMILES Cc1cc(NCc2c(F)ccc(C)c2Cl)c2cccc(C(N)=O)c2n1
Show InChI InChI=1S/C19H17ClFN3O/c1-10-6-7-15(21)14(17(10)20)9-23-16-8-11(2)24-18-12(16)4-3-5-13(18)19(22)25/h3-8H,9H2,1-2H3,(H2,22,25)(H,23,24)
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KEGG

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PC cid
PC sid
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PubMed
n/an/a 280n/an/an/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human CD38 extracellular domain expressed in Pichia pastoris using CHAPS and NAD by colorimetric-based assay

J Med Chem 58: 7021-56 (2015)


BindingDB Entry DOI: 10.7270/Q2542QCX
More data for this
Ligand-Target Pair