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BDBM50331732 2-((R)-9-((S)-1-(4-chloro-3-fluorophenyl)ethyl)-6-fluoro-8-(methylsulfonyl)-2,3,4,9-tetrahydro-1H-carbazol-1-yl)acetic acid::CHEMBL1290080

SMILES: C[C@@H](c1ccc(Cl)c(F)c1)n1c2[C@@H](CC(O)=O)CCCc2c2cc(F)cc(c12)S(C)(=O)=O

InChI Key: InChIKey=PZOJAPPZAXUOPF-GXTWGEPZSA-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 = 50331732   
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 DP receptor


(Homo sapiens (Human))
BDBM50331732
PNG
(2-((R)-9-((S)-1-(4-chloro-3-fluorophenyl)ethyl)-6-...)
Show SMILES C[C@@H](c1ccc(Cl)c(F)c1)n1c2[C@@H](CC(O)=O)CCCc2c2cc(F)cc(c12)S(C)(=O)=O |r|
Show InChI InChI=1S/C23H22ClF2NO4S/c1-12(13-6-7-18(24)19(26)8-13)27-22-14(9-21(28)29)4-3-5-16(22)17-10-15(25)11-20(23(17)27)32(2,30)31/h6-8,10-12,14H,3-5,9H2,1-2H3,(H,28,29)/t12-,14+/m0/s1
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
0.380n/an/an/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at prostanoid DP1 receptor


Bioorg Med Chem Lett 20: 7462-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.018
BindingDB Entry DOI: 10.7270/Q2PZ5920
More data for this
Ligand-Target Pair
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50331732
PNG
(2-((R)-9-((S)-1-(4-chloro-3-fluorophenyl)ethyl)-6-...)
Show SMILES C[C@@H](c1ccc(Cl)c(F)c1)n1c2[C@@H](CC(O)=O)CCCc2c2cc(F)cc(c12)S(C)(=O)=O |r|
Show InChI InChI=1S/C23H22ClF2NO4S/c1-12(13-6-7-18(24)19(26)8-13)27-22-14(9-21(28)29)4-3-5-16(22)17-10-15(25)11-20(23(17)27)32(2,30)31/h6-8,10-12,14H,3-5,9H2,1-2H3,(H,28,29)/t12-,14+/m0/s1
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
200n/an/an/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at prostanoid TP receptor


Bioorg Med Chem Lett 20: 7462-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.018
BindingDB Entry DOI: 10.7270/Q2PZ5920
More data for this
Ligand-Target Pair