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BDBM50002773 11-[2-(Toluene-4-sulfonylamino)-ethylsulfanyl]-6,11-dihydro-dibenzo[b,e]oxepine-2-carboxylic acid::CHEMBL114826

SMILES: Cc1ccc(cc1)S(=O)(=O)NCCSC1c2ccccc2COc2ccc(cc12)C(O)=O

InChI Key: InChIKey=IXFKOWVYYUPNQU-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 = 50002773   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Thromboxane A2 receptor


(Homo sapiens (Human))
BDBM50002773
PNG
(11-[2-(Toluene-4-sulfonylamino)-ethylsulfanyl]-6,1...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)NCCSC1c2ccccc2COc2ccc(cc12)C(O)=O
Show InChI InChI=1S/C24H23NO5S2/c1-16-6-9-19(10-7-16)32(28,29)25-12-13-31-23-20-5-3-2-4-18(20)15-30-22-11-8-17(24(26)27)14-21(22)23/h2-11,14,23,25H,12-13,15H2,1H3,(H,26,27)
UniProtKB/SwissProt

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AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
27n/an/an/an/an/an/an/an/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
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50002773
PNG
(11-[2-(Toluene-4-sulfonylamino)-ethylsulfanyl]-6,1...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)NCCSC1c2ccccc2COc2ccc(cc12)C(O)=O
Show InChI InChI=1S/C24H23NO5S2/c1-16-6-9-19(10-7-16)32(28,29)25-12-13-31-23-20-5-3-2-4-18(20)15-30-22-11-8-17(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
27n/an/an/an/an/an/an/an/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