BDBM50183878 ((R)-2-{(S)-2-[(4-carbamimidoyl-3-methyl-thiophen-2-ylmethyl)-carbamoyl]-2,5-dihydro-pyrrol-1-yl}-1-cyclohexylmethyl-2-oxo-ethylamino)-acetic acid::CHEMBL427037

SMILES: Cc1c(CNC(=O)[C@@H]2C=CCN2C(=O)[C@@H](CC2CCCCC2)NCC(O)=O)scc1C(N)=N

InChI Key: InChIKey=YFEQOILVCDHIMA-MSOLQXFVSA-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 = 50183878   

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))	BDBM50183878 (((R)-2-{(S)-2-[(4-carbamimidoyl-3-methyl-thiophen-...) Show SMILES Cc1c(CNC(=O)[C@@H]2C=CCN2C(=O)[C@@H](CC2CCCCC2)NCC(O)=O)scc1C(N)=N |c:8| Show InChI InChI=1S/C23H33N5O4S/c1-14-16(21(24)25)13-33-19(14)11-27-22(31)18-8-5-9-28(18)23(32)17(26-12-20(29)30)10-15-6-3-2-4-7-15/h5,8,13,15,17-18,26H,2-4,6-7,9-12H2,1H3,(H3,24,25)(H,27,31)(H,29,30)/t17-,18+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.90	n/a	n/a	n/a	n/a	n/a	n/a
Abbott GmbH& Co. KG Curated by ChEMBL					Assay Description Inhibition of thrombin				Bioorg Med Chem Lett 16: 2641-7 (2006) Article DOI: 10.1016/j.bmcl.2006.02.040 BindingDB Entry DOI: 10.7270/Q2MC90T5
					More data for this Ligand-Target Pair