BDBM56642 (3-Amino-[1,2,4]triazol-4-yl)-(4-ethoxy-phenyl)-methanone::(3-amino-1,2,4-triazol-4-yl)-(4-ethoxyphenyl)methanone::(3-amino-1,2,4-triazol-4-yl)-p-phenetyl-methanone::(3-azanyl-1,2,4-triazol-4-yl)-(4-ethoxyphenyl)methanone::MLS000527864::SMR000120438::cid_891558

SMILES: CCOc1ccc(cc1)C(=O)n1cnnc1N

InChI Key: InChIKey=ZJMVQTUMNKVEBT-UHFFFAOYSA-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 = 56642   

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
Kallikrein 5 (Homo sapiens (Human))	BDBM56642 ((3-Amino-[1,2,4]triazol-4-yl)-(4-ethoxy-phenyl)-me...) Show SMILES CCOc1ccc(cc1)C(=O)n1cnnc1N Show InChI InChI=1S/C11H12N4O2/c1-2-17-9-5-3-8(4-6-9)10(16)15-7-13-14-11(15)12/h3-7H,2H2,1H3,(H2,12,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	450	n/a	n/a	n/a	n/a	n/a	n/a
PCMD Curated by PubChem BioAssay					Assay Description Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2GH9GC8
					More data for this Ligand-Target Pair