BDBM50037352 2-[2-Oxo-6-phenyl-3-((S)-3-pyridin-4-ylmethyl-ureido)-2H-pyridin-1-yl]-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::2-[2-Oxo-6-phenyl-3-(3-pyridin-4-ylmethyl-ureido)-2H-pyridin-1-yl]-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::CHEMBL278222

SMILES: CC(C)C(NC(=O)Cn1c(ccc(NC(=O)NCc2ccncc2)c1=O)-c1ccccc1)C(=O)C(F)(F)F

InChI Key: InChIKey=UTKFBCLYFMQFLR-UHFFFAOYSA-N

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 = 50037352   

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
Leukocyte elastase (Homo sapiens (Human))	BDBM50037352 (2-[2-Oxo-6-phenyl-3-((S)-3-pyridin-4-ylmethyl-urei...) Show SMILES CC(C)C(NC(=O)Cn1c(ccc(NC(=O)NCc2ccncc2)c1=O)-c1ccccc1)C(=O)C(F)(F)F Show InChI InChI=1S/C26H26F3N5O4/c1-16(2)22(23(36)26(27,28)29)33-21(35)15-34-20(18-6-4-3-5-7-18)9-8-19(24(34)37)32-25(38)31-14-17-10-12-30-13-11-17/h3-13,16,22H,14-15H2,1-2H3,(H,33,35)(H2,31,32,38)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ZENECA Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of Human Neutrophil Elastase-catalyzed hydrolysis of the synthetic substrate MeO-Suc-Ala-Ala-Pro-Val-p- nitroanilide.				J Med Chem 39: 1112-24 (1996) Article DOI: 10.1021/jm950684z BindingDB Entry DOI: 10.7270/Q25Q4V6Z
					More data for this Ligand-Target Pair
Leukocyte elastase (Homo sapiens (Human))	BDBM50037352 (2-[2-Oxo-6-phenyl-3-((S)-3-pyridin-4-ylmethyl-urei...) Show SMILES CC(C)C(NC(=O)Cn1c(ccc(NC(=O)NCc2ccncc2)c1=O)-c1ccccc1)C(=O)C(F)(F)F Show InChI InChI=1S/C26H26F3N5O4/c1-16(2)22(23(36)26(27,28)29)33-21(35)15-34-20(18-6-4-3-5-7-18)9-8-19(24(34)37)32-25(38)31-14-17-10-12-30-13-11-17/h3-13,16,22H,14-15H2,1-2H3,(H,33,35)(H2,31,32,38)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Zeneca Pharmaceuticals Group Curated by ChEMBL					Assay Description Binding affinity against human leukocyte elastase (HLE) enzyme				J Med Chem 37: 3313-26 (1994) BindingDB Entry DOI: 10.7270/Q2NK3D3T
					More data for this Ligand-Target Pair