BDBM50002769 11-[2-(4-Methoxy-benzenesulfonylamino)-ethylsulfanyl]-6,11-dihydro-dibenzo[b,e]oxepine-2-carboxylic acid::CHEMBL324583

SMILES: COc1ccc(cc1)S(=O)(=O)NCCSC1c2ccccc2COc2ccc(cc12)C(O)=O

InChI Key: InChIKey=HBZSPSAQZLOZBX-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50002769   

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
Thromboxane A2 receptor (Homo sapiens (Human))	BDBM50002769 (11-[2-(4-Methoxy-benzenesulfonylamino)-ethylsulfan...) Show SMILES COc1ccc(cc1)S(=O)(=O)NCCSC1c2ccccc2COc2ccc(cc12)C(O)=O Show InChI InChI=1S/C24H23NO6S2/c1-30-18-7-9-19(10-8-18)33(28,29)25-12-13-32-23-20-5-3-2-4-17(20)15-31-22-11-6-16(24(26)27)14-21(22)23/h2-11,14,23,25H,12-13,15H2,1H3,(H,26,27)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kyowa Hakko Kogyo Company, Ltd. Curated by ChEMBL					Assay Description Compound was tested for its inhibitory activity against Thromboxane A2 synthase obtained from bovine platelet microsomes				J Med Chem 35: 3394-402 (1992) BindingDB Entry DOI: 10.7270/Q2NS0SV5
					More data for this Ligand-Target Pair
Prostanoid TP receptor (Homo sapiens (Human))	BDBM50002769 (11-[2-(4-Methoxy-benzenesulfonylamino)-ethylsulfan...) Show SMILES COc1ccc(cc1)S(=O)(=O)NCCSC1c2ccccc2COc2ccc(cc12)C(O)=O Show InChI InChI=1S/C24H23NO6S2/c1-30-18-7-9-19(10-8-18)33(28,29)25-12-13-32-23-20-5-3-2-4-17(20)15-31-22-11-6-16(24(26)27)14-21(22)23/h2-11,14,23,25H,12-13,15H2,1H3,(H,26,27)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kyowa Hakko Kogyo Company, Ltd. Curated by ChEMBL					Assay Description Binding affinity at TXA2 receptor by measuring its ability to displace [3H]-U-46,619 from guinea pig platelets				J Med Chem 35: 3394-402 (1992) BindingDB Entry DOI: 10.7270/Q2NS0SV5
					More data for this Ligand-Target Pair