BDBM50289526 CHEMBL37035::N-(1-{[(1-Carbamimidoyl-piperidin-4-ylmethyl)-carbamoyl]-methyl}-6-methyl-2-oxo-1,2-dihydro-pyridin-3-yl)-3,3-diphenyl-propionamide

SMILES: Cc1ccc(NC(=O)CC(c2ccccc2)c2ccccc2)c(=O)n1CC(=O)NCC1CCN(CC1)C(N)=N

InChI Key: InChIKey=MTZGOMUZAAZNCZ-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 = 50289526   

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
Prothrombin (Homo sapiens (Human))	BDBM50289526 (CHEMBL37035 | N-(1-{[(1-Carbamimidoyl-piperidin-4-...) Show SMILES Cc1ccc(NC(=O)CC(c2ccccc2)c2ccccc2)c(=O)n1CC(=O)NCC1CCN(CC1)C(N)=N Show InChI InChI=1S/C30H36N6O3/c1-21-12-13-26(29(39)36(21)20-28(38)33-19-22-14-16-35(17-15-22)30(31)32)34-27(37)18-25(23-8-4-2-5-9-23)24-10-6-3-7-11-24/h2-13,22,25H,14-20H2,1H3,(H3,31,32)(H,33,38)(H,34,37)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	166	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity against human thrombin				Bioorg Med Chem Lett 7: 1497-1500 (1997) Article DOI: 10.1016/S0960-894X(97)00257-6 BindingDB Entry DOI: 10.7270/Q2P55P15
					More data for this Ligand-Target Pair
Trypsin-1 (Homo sapiens (Human))	BDBM50289526 (CHEMBL37035 | N-(1-{[(1-Carbamimidoyl-piperidin-4-...) Show SMILES Cc1ccc(NC(=O)CC(c2ccccc2)c2ccccc2)c(=O)n1CC(=O)NCC1CCN(CC1)C(N)=N Show InChI InChI=1S/C30H36N6O3/c1-21-12-13-26(29(39)36(21)20-28(38)33-19-22-14-16-35(17-15-22)30(31)32)34-27(37)18-25(23-8-4-2-5-9-23)24-10-6-3-7-11-24/h2-13,22,25H,14-20H2,1H3,(H3,31,32)(H,33,38)(H,34,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	890	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity against human trypsin				Bioorg Med Chem Lett 7: 1497-1500 (1997) Article DOI: 10.1016/S0960-894X(97)00257-6 BindingDB Entry DOI: 10.7270/Q2P55P15
					More data for this Ligand-Target Pair