BDBM50093063 (R)-5-Guanidino-2-phenylmethanesulfonylamino-pentanoic acid [((S)-1-cyclohexylmethyl-2-oxo-2-phenethylcarbamoyl-ethylcarbamoyl)-methyl]-methyl-amide::CHEMBL74955

SMILES: CN(CC(=O)N[C@@H](CC1CCCCC1)C(=O)C(=O)NCCc1ccccc1)C(=O)[C@@H](CCCNC(N)=N)NS(=O)(=O)Cc1ccccc1

InChI Key: InChIKey=LRXQXKLOGRGIPF-WDYNHAJCSA-N

Data: 3 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 3 hits for monomerid = 50093063   

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))	BDBM50093063 ((R)-5-Guanidino-2-phenylmethanesulfonylamino-penta...) Show SMILES CN(CC(=O)N[C@@H](CC1CCCCC1)C(=O)C(=O)NCCc1ccccc1)C(=O)[C@@H](CCCNC(N)=N)NS(=O)(=O)Cc1ccccc1 Show InChI InChI=1S/C34H49N7O6S/c1-41(33(45)28(18-11-20-38-34(35)36)40-48(46,47)24-27-16-9-4-10-17-27)23-30(42)39-29(22-26-14-7-3-8-15-26)31(43)32(44)37-21-19-25-12-5-2-6-13-25/h2,4-6,9-10,12-13,16-17,26,28-29,40H,3,7-8,11,14-15,18-24H2,1H3,(H,37,44)(H,39,42)(H4,35,36,38)/t28-,29+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.21E+3	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description Compound was evaluated in vitro for its inhibitory activity against Thrombin (FIIa)				Bioorg Med Chem Lett 10: 2305-9 (2001) BindingDB Entry DOI: 10.7270/Q25Q4VBR
					More data for this Ligand-Target Pair
Trypsin-1 (Homo sapiens (Human))	BDBM50093063 ((R)-5-Guanidino-2-phenylmethanesulfonylamino-penta...) Show SMILES CN(CC(=O)N[C@@H](CC1CCCCC1)C(=O)C(=O)NCCc1ccccc1)C(=O)[C@@H](CCCNC(N)=N)NS(=O)(=O)Cc1ccccc1 Show InChI InChI=1S/C34H49N7O6S/c1-41(33(45)28(18-11-20-38-34(35)36)40-48(46,47)24-27-16-9-4-10-17-27)23-30(42)39-29(22-26-14-7-3-8-15-26)31(43)32(44)37-21-19-25-12-5-2-6-13-25/h2,4-6,9-10,12-13,16-17,26,28-29,40H,3,7-8,11,14-15,18-24H2,1H3,(H,37,44)(H,39,42)(H4,35,36,38)/t28-,29+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description Compound was evaluated in vitro for its inhibitory activity against Human trypsin				Bioorg Med Chem Lett 10: 2305-9 (2001) BindingDB Entry DOI: 10.7270/Q25Q4VBR
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50093063 ((R)-5-Guanidino-2-phenylmethanesulfonylamino-penta...) Show SMILES CN(CC(=O)N[C@@H](CC1CCCCC1)C(=O)C(=O)NCCc1ccccc1)C(=O)[C@@H](CCCNC(N)=N)NS(=O)(=O)Cc1ccccc1 Show InChI InChI=1S/C34H49N7O6S/c1-41(33(45)28(18-11-20-38-34(35)36)40-48(46,47)24-27-16-9-4-10-17-27)23-30(42)39-29(22-26-14-7-3-8-15-26)31(43)32(44)37-21-19-25-12-5-2-6-13-25/h2,4-6,9-10,12-13,16-17,26,28-29,40H,3,7-8,11,14-15,18-24H2,1H3,(H,37,44)(H,39,42)(H4,35,36,38)/t28-,29+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description Inhibitory activity against Coagulation factor X				Bioorg Med Chem Lett 10: 2305-9 (2001) BindingDB Entry DOI: 10.7270/Q25Q4VBR
					More data for this Ligand-Target Pair