BDBM50307276 (5-Ethylaminomethyl-1,3-dimethyl-1H-pyrazol-4-yl)-carbamic acid 2-(2-carbamimidoyl-benzo[b]thiophen-4-yloxy)-2-phenyl-ethyl ester::CHEMBL602082

SMILES: CNCc1c(NC(=O)OCC(Oc2cccc3sc(cc23)C(N)=N)c2ccccc2)c(C)nn1C

InChI Key: InChIKey=MGOLGCRWUARCLB-UHFFFAOYSA-N

Data: 3 KI

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 = 50307276   

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 IX (Homo sapiens (Human))	BDBM50307276 ((5-Ethylaminomethyl-1,3-dimethyl-1H-pyrazol-4-yl)-...) Show SMILES CNCc1c(NC(=O)OCC(Oc2cccc3sc(cc23)C(N)=N)c2ccccc2)c(C)nn1C Show InChI InChI=1S/C25H28N6O3S/c1-15-23(18(13-28-2)31(3)30-15)29-25(32)33-14-20(16-8-5-4-6-9-16)34-19-10-7-11-21-17(19)12-22(35-21)24(26)27/h4-12,20,28H,13-14H2,1-3H3,(H3,26,27)(H,29,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Trigen Ltd. Curated by ChEMBL					Assay Description Inhibition of human recombinant factor 9a by amidolytic assay				J Med Chem 53: 1473-82 (2010) Article DOI: 10.1021/jm901476x BindingDB Entry DOI: 10.7270/Q2P84C0N
					More data for this Ligand-Target Pair
Urokinase-type plasminogen activator (Homo sapiens (Human))	BDBM50307276 ((5-Ethylaminomethyl-1,3-dimethyl-1H-pyrazol-4-yl)-...) Show SMILES CNCc1c(NC(=O)OCC(Oc2cccc3sc(cc23)C(N)=N)c2ccccc2)c(C)nn1C Show InChI InChI=1S/C25H28N6O3S/c1-15-23(18(13-28-2)31(3)30-15)29-25(32)33-14-20(16-8-5-4-6-9-16)34-19-10-7-11-21-17(19)12-22(35-21)24(26)27/h4-12,20,28H,13-14H2,1-3H3,(H3,26,27)(H,29,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	156	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Trigen Ltd. Curated by ChEMBL					Assay Description Inhibition of uPA				J Med Chem 53: 1473-82 (2010) Article DOI: 10.1021/jm901476x BindingDB Entry DOI: 10.7270/Q2P84C0N
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50307276 ((5-Ethylaminomethyl-1,3-dimethyl-1H-pyrazol-4-yl)-...) Show SMILES CNCc1c(NC(=O)OCC(Oc2cccc3sc(cc23)C(N)=N)c2ccccc2)c(C)nn1C Show InChI InChI=1S/C25H28N6O3S/c1-15-23(18(13-28-2)31(3)30-15)29-25(32)33-14-20(16-8-5-4-6-9-16)34-19-10-7-11-21-17(19)12-22(35-21)24(26)27/h4-12,20,28H,13-14H2,1-3H3,(H3,26,27)(H,29,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	2.38E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Trigen Ltd. Curated by ChEMBL					Assay Description Inhibition of factor 10a by amidolytic assay				J Med Chem 53: 1473-82 (2010) Article DOI: 10.1021/jm901476x BindingDB Entry DOI: 10.7270/Q2P84C0N
					More data for this Ligand-Target Pair