BDBM50210435 (S)-1-[(2R,3R)-2-((R)-2-hydroxy-3-phenyl-propionylamino)-3-methyl-pentanoyl]-pyrrolidine-2-carboxylic acid 4-carbamimidoyl-benzylamide::CHEMBL246295

SMILES: CC[C@@H](C)[C@@H](NC(=O)[C@H](O)Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)NCc1ccc(cc1)C(N)=N

InChI Key: InChIKey=UVYOIYDMRJXPIF-VCFYHUQZSA-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 = 50210435   

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))	BDBM50210435 ((S)-1-[(2R,3R)-2-((R)-2-hydroxy-3-phenyl-propionyl...) Show SMILES CC[C@@H](C)[C@@H](NC(=O)[C@H](O)Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)NCc1ccc(cc1)C(N)=N Show InChI InChI=1S/C28H37N5O4/c1-3-18(2)24(32-27(36)23(34)16-19-8-5-4-6-9-19)28(37)33-15-7-10-22(33)26(35)31-17-20-11-13-21(14-12-20)25(29)30/h4-6,8-9,11-14,18,22-24,34H,3,7,10,15-17H2,1-2H3,(H3,29,30)(H,31,35)(H,32,36)/t18-,22+,23-,24-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Université de Montréal Curated by ChEMBL					Assay Description Inhibition of thrombin				Bioorg Med Chem Lett 17: 3480-5 (2007) Article DOI: 10.1016/j.bmcl.2007.03.075 BindingDB Entry DOI: 10.7270/Q25M65FJ
					More data for this Ligand-Target Pair