BDBM50356201 CHEMBL1910224

SMILES: COc1cc(C=NNC(N)=S)cc(OC)c1O

InChI Key: InChIKey=VQIQQYLIOAABJK-UHFFFAOYSA-N

Data: 1 KI  1 IC50

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 = 50356201   

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
Urease (Canavalia ensiformis (Jack bean) (Horse bean))	BDBM50356201 (CHEMBL1910224) Show SMILES COc1cc(C=NNC(N)=S)cc(OC)c1O |w:6.6| Show InChI InChI=1S/C10H13N3O3S/c1-15-7-3-6(5-12-13-10(11)17)4-8(16-2)9(7)14/h3-5,14H,1-2H3,(H3,11,13,17)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	134	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
COMSATS Institute of Information Technology Curated by ChEMBL					Assay Description Inhibition of jack bean urease assessed as ammonia production after 30 mins by indophenol method				Eur J Med Chem 46: 5473-9 (2011) Article DOI: 10.1016/j.ejmech.2011.09.009 BindingDB Entry DOI: 10.7270/Q2GM87QH
					More data for this Ligand-Target Pair
Urease (Canavalia ensiformis (Jack bean) (Horse bean))	BDBM50356201 (CHEMBL1910224) Show SMILES COc1cc(C=NNC(N)=S)cc(OC)c1O |w:6.6| Show InChI InChI=1S/C10H13N3O3S/c1-15-7-3-6(5-12-13-10(11)17)4-8(16-2)9(7)14/h3-5,14H,1-2H3,(H3,11,13,17)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	233	n/a	n/a	n/a	n/a	n/a	n/a
COMSATS Institute of Information Technology Curated by ChEMBL					Assay Description Inhibition of jack bean urease assessed as ammonia production after 30 mins by indophenol method				Eur J Med Chem 46: 5473-9 (2011) Article DOI: 10.1016/j.ejmech.2011.09.009 BindingDB Entry DOI: 10.7270/Q2GM87QH
					More data for this Ligand-Target Pair