Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine deaminase' and Ligand = 'BDBM50031264'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Adenosine deaminase (Bos taurus (bovine))	BDBM50031264 (5-(7-Cyclopentylamino-imidazo[4,5-b]pyridin-3-yl)-...) Show SMILES OCC1OC(CC1O)n1cnc2c(NC3CCCC3)ccnc12 Show InChI InChI=1S/C16H22N4O3/c21-8-13-12(22)7-14(23-13)20-9-18-15-11(5-6-17-16(15)20)19-10-3-1-2-4-10/h5-6,9-10,12-14,21-22H,1-4,7-8H2,(H,17,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.20E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Camerino Curated by ChEMBL					Assay Description Inhibition calf intestine adenosine deaminase				J Med Chem 38: 4019-25 (1995) BindingDB Entry DOI: 10.7270/Q2RB757R
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