BDBM50280655 3-Isobutyryloxy-benzo[4,5]thieno[3,2-b]furan-2-carboxylic acid methyl ester::CHEMBL268367

SMILES: COC(=O)c1oc2c(sc3ccccc23)c1OC(=O)C(C)C

InChI Key: InChIKey=STCBJZIZCOASHY-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 50280655   

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 (Bos taurus)	BDBM50280655 (3-Isobutyryloxy-benzo[4,5]thieno[3,2-b]furan-2-car...) Show SMILES COC(=O)c1oc2c(sc3ccccc23)c1OC(=O)C(C)C Show InChI InChI=1S/C16H14O5S/c1-8(2)15(17)21-12-13(16(18)19-3)20-11-9-6-4-5-7-10(9)22-14(11)12/h4-8H,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro concentration of compound required to inhibit 50% of Factor Xa				Bioorg Med Chem Lett 2: 1025-1028 (1992) Article DOI: 10.1016/S0960-894X(00)80611-3 BindingDB Entry DOI: 10.7270/Q2X066XV
					More data for this Ligand-Target Pair
Trypsin (Bos taurus (bovine))	BDBM50280655 (3-Isobutyryloxy-benzo[4,5]thieno[3,2-b]furan-2-car...) Show SMILES COC(=O)c1oc2c(sc3ccccc23)c1OC(=O)C(C)C Show InChI InChI=1S/C16H14O5S/c1-8(2)15(17)21-12-13(16(18)19-3)20-11-9-6-4-5-7-10(9)22-14(11)12/h4-8H,1-3H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro concentration of compound required to inhibit 50% of trypsin				Bioorg Med Chem Lett 2: 1025-1028 (1992) Article DOI: 10.1016/S0960-894X(00)80611-3 BindingDB Entry DOI: 10.7270/Q2X066XV
					More data for this Ligand-Target Pair
Plasminogen (Homo sapiens (Human))	BDBM50280655 (3-Isobutyryloxy-benzo[4,5]thieno[3,2-b]furan-2-car...) Show SMILES COC(=O)c1oc2c(sc3ccccc23)c1OC(=O)C(C)C Show InChI InChI=1S/C16H14O5S/c1-8(2)15(17)21-12-13(16(18)19-3)20-11-9-6-4-5-7-10(9)22-14(11)12/h4-8H,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.40E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro concentration of compound required to inhibit 50% of Plasmin				Bioorg Med Chem Lett 2: 1025-1028 (1992) Article DOI: 10.1016/S0960-894X(00)80611-3 BindingDB Entry DOI: 10.7270/Q2X066XV
					More data for this Ligand-Target Pair
Thrombin (Bos taurus (Bovine))	BDBM50280655 (3-Isobutyryloxy-benzo[4,5]thieno[3,2-b]furan-2-car...) Show SMILES COC(=O)c1oc2c(sc3ccccc23)c1OC(=O)C(C)C Show InChI InChI=1S/C16H14O5S/c1-8(2)15(17)21-12-13(16(18)19-3)20-11-9-6-4-5-7-10(9)22-14(11)12/h4-8H,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro concentration of compound required to inhibit 50% of 6 nM thrombin				Bioorg Med Chem Lett 2: 1025-1028 (1992) Article DOI: 10.1016/S0960-894X(00)80611-3 BindingDB Entry DOI: 10.7270/Q2X066XV
					More data for this Ligand-Target Pair
Plasma kallikrein (Homo sapiens (Human))	BDBM50280655 (3-Isobutyryloxy-benzo[4,5]thieno[3,2-b]furan-2-car...) Show SMILES COC(=O)c1oc2c(sc3ccccc23)c1OC(=O)C(C)C Show InChI InChI=1S/C16H14O5S/c1-8(2)15(17)21-12-13(16(18)19-3)20-11-9-6-4-5-7-10(9)22-14(11)12/h4-8H,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	7.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro concentration of compound required to inhibit 50% of Kallikrein				Bioorg Med Chem Lett 2: 1025-1028 (1992) Article DOI: 10.1016/S0960-894X(00)80611-3 BindingDB Entry DOI: 10.7270/Q2X066XV
					More data for this Ligand-Target Pair