BDBM50087301 CHEMBL290418::Sodium; 4-(8-hydroxy-7,8-dihydro-6H-imidazo[4,5-d][1,3]diazepin-3-ylmethoxy)-butyrate H2O

SMILES: OC1CNC=Nc2c1ncn2COCCCC([O-])=O

InChI Key: InChIKey=MBGXSXWOCNCYTQ-UHFFFAOYSA-M

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 = 50087301   

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 1 (hAMPD1) (Homo sapiens (Human))	BDBM50087301 (CHEMBL290418 | Sodium; 4-(8-hydroxy-7,8-dihydro-6H...) Show SMILES OC1CNC=Nc2c1ncn2COCCCC([O-])=O |c:4| Show InChI InChI=1S/C11H16N4O4/c16-8-4-12-5-13-11-10(8)14-6-15(11)7-19-3-1-2-9(17)18/h5-6,8,16H,1-4,7H2,(H,12,13)(H,17,18)/p-1	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	8.50E+4	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))	BDBM50087301 (CHEMBL290418 | Sodium; 4-(8-hydroxy-7,8-dihydro-6H...) Show SMILES OC1CNC=Nc2c1ncn2COCCCC([O-])=O |c:4| Show InChI InChI=1S/C11H16N4O4/c16-8-4-12-5-13-11-10(8)14-6-15(11)7-19-3-1-2-9(17)18/h5-6,8,16H,1-4,7H2,(H,12,13)(H,17,18)/p-1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>5.00E+5	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