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BDBM50002786 11-[2-(1H-Benzoimidazol-2-yl)-ethylsulfanyl]-6,11-dihydro-dibenzo[b,e]oxepine-2-carboxylic acid (1.5H2O)::CHEMBL326856

SMILES: OC(=O)c1ccc2OCc3ccccc3C(SCCc3nc4ccccc4[nH]3)c2c1

InChI Key: InChIKey=WJUMLQBIJXGXOC-UHFFFAOYNA-N

Data: 1 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 1 hit for monomerid = 50002786   
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
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50002786
PNG
(11-[2-(1H-Benzoimidazol-2-yl)-ethylsulfanyl]-6,11-...)
Show SMILES OC(=O)c1ccc2OCc3ccccc3C(SCCc3nc4ccccc4[nH]3)c2c1
Show InChI InChI=1/C24H20N2O3S/c27-24(28)15-9-10-21-18(13-15)23(17-6-2-1-5-16(17)14-29-21)30-12-11-22-25-19-7-3-4-8-20(19)26-22/h1-10,13,23H,11-12,14H2,(H,25,26)(H,27,28)
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
7.60n/an/an/an/an/an/an/an/a



Kyowa Hakko Kogyo Co., Ltd

Curated by ChEMBL


Assay Description
Binding affinity at TXA2/PGH2 receptor by measuring its ability to displace [3H]-U-46,619 from guinea pig platelets


J Med Chem 35: 3402-13 (1992)


Article DOI: 10.1021/jm00096a017
BindingDB Entry DOI: 10.7270/Q2J38RG1
More data for this
Ligand-Target Pair