null

SMILES: CCOC(=O)c1cc(CCn2cnc3C(O)CNC=Nc23)c2cc(Br)ccc2c1

InChI Key: InChIKey=LROMFLPKEXQPSI-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50096158   

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
Adenosine deaminase (Bos taurus (bovine))	BDBM50096158 (6-Bromo-4-[2-(8-hydroxy-7,8-dihydro-6H-imidazo[4,5...) Show SMILES CCOC(=O)c1cc(CCn2cnc3C(O)CNC=Nc23)c2cc(Br)ccc2c1 |c:18| Show InChI InChI=1S/C21H21BrN4O3/c1-2-29-21(28)15-7-13-3-4-16(22)9-17(13)14(8-15)5-6-26-12-25-19-18(27)10-23-11-24-20(19)26/h3-4,7-9,11-12,18,27H,2,5-6,10H2,1H3,(H,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4.40E+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 Inhibition of Calf intestinal adenosine deaminase (ADA).				J Med Chem 44: 613-8 (2001) BindingDB Entry DOI: 10.7270/Q2BZ659R
					More data for this Ligand-Target Pair
AMP deaminase 3 (Homo sapiens (Human))	BDBM50096158 (6-Bromo-4-[2-(8-hydroxy-7,8-dihydro-6H-imidazo[4,5...) Show SMILES CCOC(=O)c1cc(CCn2cnc3C(O)CNC=Nc23)c2cc(Br)ccc2c1 |c:18| Show InChI InChI=1S/C21H21BrN4O3/c1-2-29-21(28)15-7-13-3-4-16(22)9-17(13)14(8-15)5-6-26-12-25-19-18(27)10-23-11-24-20(19)26/h3-4,7-9,11-12,18,27H,2,5-6,10H2,1H3,(H,23,24)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.40E+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 Inhibition of recombinant human E-type adenylate deaminase				J Med Chem 44: 613-8 (2001) BindingDB Entry DOI: 10.7270/Q2BZ659R
					More data for this Ligand-Target Pair