BDBM50098482 4-(4-Methoxy-phenylsulfanyl)-thieno[2,3-c]pyridine-2-carboxylic acid amide::CHEMBL263081

SMILES: COc1ccc(Sc2cncc3sc(cc23)C(N)=O)cc1

InChI Key: InChIKey=RMBAIZKYEXOATM-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50098482   

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
Intercellular adhesion molecule (ICAM-1), Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50098482 (4-(4-Methoxy-phenylsulfanyl)-thieno[2,3-c]pyridine...) Show SMILES COc1ccc(Sc2cncc3sc(cc23)C(N)=O)cc1 Show InChI InChI=1S/C15H12N2O2S2/c1-19-9-2-4-10(5-3-9)20-13-7-17-8-14-11(13)6-12(21-14)15(16)18/h2-8H,1H3,(H2,16,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro potency against TNF alpha induced expresion of intercellular adhesion molecule-1 on human vascular endothelial cells using CAM ELISA assay				J Med Chem 44: 988-1002 (2001) BindingDB Entry DOI: 10.7270/Q2CF9PC4
					More data for this Ligand-Target Pair
Selectin E (Homo sapiens (Human))	BDBM50098482 (4-(4-Methoxy-phenylsulfanyl)-thieno[2,3-c]pyridine...) Show SMILES COc1ccc(Sc2cncc3sc(cc23)C(N)=O)cc1 Show InChI InChI=1S/C15H12N2O2S2/c1-19-9-2-4-10(5-3-9)20-13-7-17-8-14-11(13)6-12(21-14)15(16)18/h2-8H,1H3,(H2,16,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro potency against TNF alpha induced expression of Selectin E on human vascular endothelial cells using CAM ELISA assay				J Med Chem 44: 988-1002 (2001) BindingDB Entry DOI: 10.7270/Q2CF9PC4
					More data for this Ligand-Target Pair
VCAM-1 (Homo sapiens (Human))	BDBM50098482 (4-(4-Methoxy-phenylsulfanyl)-thieno[2,3-c]pyridine...) Show SMILES COc1ccc(Sc2cncc3sc(cc23)C(N)=O)cc1 Show InChI InChI=1S/C15H12N2O2S2/c1-19-9-2-4-10(5-3-9)20-13-7-17-8-14-11(13)6-12(21-14)15(16)18/h2-8H,1H3,(H2,16,18)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	>200	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro potency against TNF alpha induced expresion of VCAM-1 on human vascular endothelial cells using CAM ELISA assay				J Med Chem 44: 988-1002 (2001) BindingDB Entry DOI: 10.7270/Q2CF9PC4
					More data for this Ligand-Target Pair