BDBM50076954 ((R)-2-Cyclohexyl-1-{[(2-oxo-1-piperidin-4-ylmethyl-2-thiazol-2-yl-ethylcarbamoyl)-methyl]-carbamoyl}-ethylamino)-acetic acid::CHEMBL21212

SMILES: OC(=O)CN[C@H](CC1CCCCC1)C(=O)NCC(=O)NC(CC1CCNCC1)C(=O)c1nccs1

InChI Key: InChIKey=HAXCRJUOVXOSCT-MUMRKEEXSA-N

Data: 2 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 2 hits for monomerid = 50076954   

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))	BDBM50076954 (((R)-2-Cyclohexyl-1-{[(2-oxo-1-piperidin-4-ylmethy...) Show SMILES OC(=O)CN[C@H](CC1CCCCC1)C(=O)NCC(=O)NC(CC1CCNCC1)C(=O)c1nccs1 Show InChI InChI=1S/C24H37N5O5S/c30-20(14-28-23(34)19(27-15-21(31)32)13-16-4-2-1-3-5-16)29-18(12-17-6-8-25-9-7-17)22(33)24-26-10-11-35-24/h10-11,16-19,25,27H,1-9,12-15H2,(H,28,34)(H,29,30)(H,31,32)/t18?,19-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.94E+4	n/a	n/a	n/a	n/a	n/a	n/a
Research and Development Curated by ChEMBL					Assay Description Inhibitory activity against thrombin with respect to Argatroban				Bioorg Med Chem Lett 9: 1227-32 (1999) BindingDB Entry DOI: 10.7270/Q2XW4K9J
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50076954 (((R)-2-Cyclohexyl-1-{[(2-oxo-1-piperidin-4-ylmethy...) Show SMILES OC(=O)CN[C@H](CC1CCCCC1)C(=O)NCC(=O)NC(CC1CCNCC1)C(=O)c1nccs1 Show InChI InChI=1S/C24H37N5O5S/c30-20(14-28-23(34)19(27-15-21(31)32)13-16-4-2-1-3-5-16)29-18(12-17-6-8-25-9-7-17)22(33)24-26-10-11-35-24/h10-11,16-19,25,27H,1-9,12-15H2,(H,28,34)(H,29,30)(H,31,32)/t18?,19-/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	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Research and Development Curated by ChEMBL					Assay Description Inhibitory activity against Coagulation factor X with respect to Argatroban				Bioorg Med Chem Lett 9: 1227-32 (1999) BindingDB Entry DOI: 10.7270/Q2XW4K9J
					More data for this Ligand-Target Pair