BDBM50106619 CHEMBL3600579

SMILES: Oc1cc(O)c(\C=N\NC(=O)c2ccc(\C=C3\C(=O)Nc4ccc(Cl)cc34)cc2)cc1O

InChI Key: InChIKey=GIKXZFYSZMMEBB-IGIDEGMOSA-N

Data: 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 1 hit for monomerid = 50106619   

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))	BDBM50106619 (CHEMBL3600579) Show SMILES Oc1cc(O)c(\C=N\NC(=O)c2ccc(\C=C3\C(=O)Nc4ccc(Cl)cc34)cc2)cc1O Show InChI InChI=1S/C23H16ClN3O5/c24-15-5-6-18-16(9-15)17(23(32)26-18)7-12-1-3-13(4-2-12)22(31)27-25-11-14-8-20(29)21(30)10-19(14)28/h1-11,28-30H,(H,26,32)(H,27,31)/b17-7+,25-11+	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.26E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universiti Teknologi MARA Puncak Alam Campus Curated by ChEMBL					Assay Description Inhibition of jack bean urease using urea as substrate assessed as ammonia production after 15 mins by Weatherburn assay				Bioorg Med Chem Lett 25: 3285-9 (2015) BindingDB Entry DOI: 10.7270/Q2GT5PZZ
					More data for this Ligand-Target Pair