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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'AMP deaminase 2' and Ligand = 'BDBM50087324'   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
AMP deaminase 2


(Homo sapiens (Human))		BDBM50087324
PNG
(2-(3-Bromo-benzyl)-6-(8-hydroxy-7,8-dihydro-6H-imi...)
Show SMILES CCOC(=O)C(C)(CCCCn1cnc2C(O)CNC=Nc12)Cc1cccc(Br)c1 |c:19|
Show InChI InChI=1S/C22H29BrN4O3/c1-3-30-21(29)22(2,12-16-7-6-8-17(23)11-16)9-4-5-10-27-15-26-19-18(28)13-24-14-25-20(19)27/h6-8,11,14-15,18,28H,3-5,9-10,12-13H2,1-2H3,(H,24,25)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
 3.00E+3n/an/an/an/an/an/an/an/a



Metabasis Therapeutics Inc.

Curated by ChEMBL


Assay Description
Evaluated for the inhibition of porcine heart or human L-type Adenosine 5'-monophosphate deaminase (AMPDA)

J Med Chem 43: 1495-507 (2000)


BindingDB Entry DOI: 10.7270/Q2Z31XWJ
More data for this
Ligand-Target Pair