BDBM50167023 1-(4-Carbamimidoyl-phenyl)-4-(2-carbamimidoyl-1,2,3,4-tetrahydro-isoquinolin-7-yloxymethyl)-piperidine-4-carboxylic acid ethyl ester; hydrochloride; trihydrochloride::CHEMBL536961

SMILES: CCOC(=O)C1(COc2ccc3CCN(Cc3c2)C(N)=N)CCN(CC1)c1ccc(cc1)C(N)=N

InChI Key: InChIKey=MIQTZYRBLMTXHZ-UHFFFAOYSA-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 = 50167023   

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
Coagulation factor X (Homo sapiens (Human))	BDBM50167023 (1-(4-Carbamimidoyl-phenyl)-4-(2-carbamimidoyl-1,2,...) Show SMILES CCOC(=O)C1(COc2ccc3CCN(Cc3c2)C(N)=N)CCN(CC1)c1ccc(cc1)C(N)=N Show InChI InChI=1S/C26H34N6O3/c1-2-34-24(33)26(10-13-31(14-11-26)21-6-3-19(4-7-21)23(27)28)17-35-22-8-5-18-9-12-32(25(29)30)16-20(18)15-22/h3-8,15H,2,9-14,16-17H2,1H3,(H3,27,28)(H3,29,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
Central Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibitory concentration against human Coagulation factor X				J Med Chem 48: 3586-604 (2005) Article DOI: 10.1021/jm058160e BindingDB Entry DOI: 10.7270/Q2CR5V36
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50167023 (1-(4-Carbamimidoyl-phenyl)-4-(2-carbamimidoyl-1,2,...) Show SMILES CCOC(=O)C1(COc2ccc3CCN(Cc3c2)C(N)=N)CCN(CC1)c1ccc(cc1)C(N)=N Show InChI InChI=1S/C26H34N6O3/c1-2-34-24(33)26(10-13-31(14-11-26)21-6-3-19(4-7-21)23(27)28)17-35-22-8-5-18-9-12-32(25(29)30)16-20(18)15-22/h3-8,15H,2,9-14,16-17H2,1H3,(H3,27,28)(H3,29,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Central Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibitory concentration against human Coagulation factor II (thrombin)				J Med Chem 48: 3586-604 (2005) Article DOI: 10.1021/jm058160e BindingDB Entry DOI: 10.7270/Q2CR5V36
					More data for this Ligand-Target Pair