BDBM50087295 2-(2-Bromo-benzyl)-6-(8-hydroxy-7,8-dihydro-6H-imidazo[4,5-d][1,3]diazepin-3-yl)-hexanoic acid H2O::CHEMBL36045

SMILES: OC1CNC=Nc2c1ncn2CCCCC(Cc1ccccc1Br)C(O)=O

InChI Key: InChIKey=WFXQCDCLSNIHRG-UHFFFAOYSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50087295   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
AMP deaminase 2 (Homo sapiens (Human))	BDBM50087295 (2-(2-Bromo-benzyl)-6-(8-hydroxy-7,8-dihydro-6H-imi...) Show SMILES OC1CNC=Nc2c1ncn2CCCCC(Cc1ccccc1Br)C(O)=O |c:4| Show InChI InChI=1S/C19H23BrN4O3/c20-15-7-2-1-5-13(15)9-14(19(26)27)6-3-4-8-24-12-23-17-16(25)10-21-11-22-18(17)24/h1-2,5,7,11-12,14,16,25H,3-4,6,8-10H2,(H,21,22)(H,26,27)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	300	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/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
Adenosine deaminase (Bos taurus (bovine))	BDBM50087295 (2-(2-Bromo-benzyl)-6-(8-hydroxy-7,8-dihydro-6H-imi...) Show SMILES OC1CNC=Nc2c1ncn2CCCCC(Cc1ccccc1Br)C(O)=O |c:4| Show InChI InChI=1S/C19H23BrN4O3/c20-15-7-2-1-5-13(15)9-14(19(26)27)6-3-4-8-24-12-23-17-16(25)10-21-11-22-18(17)24/h1-2,5,7,11-12,14,16,25H,3-4,6,8-10H2,(H,21,22)(H,26,27)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>7.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Metabasis Therapeutics Inc. Curated by ChEMBL					Assay Description Evaluated for the inhibition of calf intestinal Adenosine deaminase (ADA)				J Med Chem 43: 1495-507 (2000) BindingDB Entry DOI: 10.7270/Q2Z31XWJ
					More data for this Ligand-Target Pair