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SMILES: CCCCCCCOc1cccc(CCC(=O)OC[C@@H](O)COP(O)(=O)O[C@@H](C)[C@H](N)C(O)=O)c1

InChI Key: InChIKey=ITLYIRMTAPOHDS-KPLVRAHFSA-N

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 = 50096585   
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
Probable G-protein coupled receptor 174


(Homo sapiens (Human))
BDBM50096585
PNG
(CHEMBL3577264)
Show SMILES CCCCCCCOc1cccc(CCC(=O)OC[C@@H](O)COP(O)(=O)O[C@@H](C)[C@H](N)C(O)=O)c1 |r|
Show InChI InChI=1S/C23H38NO10P/c1-3-4-5-6-7-13-31-20-10-8-9-18(14-20)11-12-21(26)32-15-19(25)16-33-35(29,30)34-17(2)22(24)23(27)28/h8-10,14,17,19,22,25H,3-7,11-13,15-16,24H2,1-2H3,(H,27,28)(H,29,30)/t17-,19+,22-/m0/s1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 724n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at GPR174 (unknown origin) transfected in HEK293FT cells after 1 hr by TGFalpha shedding assay


J Med Chem 58: 4204-19 (2015)


Article DOI: 10.1021/jm5020082
BindingDB Entry DOI: 10.7270/Q2Q81FTD
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 174


(Homo sapiens (Human))
BDBM50096585
PNG
(CHEMBL3577264)
Show SMILES CCCCCCCOc1cccc(CCC(=O)OC[C@@H](O)COP(O)(=O)O[C@@H](C)[C@H](N)C(O)=O)c1 |r|
Show InChI InChI=1S/C23H38NO10P/c1-3-4-5-6-7-13-31-20-10-8-9-18(14-20)11-12-21(26)32-15-19(25)16-33-35(29,30)34-17(2)22(24)23(27)28/h8-10,14,17,19,22,25H,3-7,11-13,15-16,24H2,1-2H3,(H,27,28)(H,29,30)/t17-,19+,22-/m0/s1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 720n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at GPR174 (unknown origin) transfected in HEK293FT cells after 1 hr by TGFalpha shedding assay


J Med Chem 58: 4204-19 (2015)


Article DOI: 10.1021/jm5020082
BindingDB Entry DOI: 10.7270/Q2Q81FTD
More data for this
Ligand-Target Pair
Putative P2Y purinoceptor 10


(Homo sapiens (Human))
BDBM50096585
PNG
(CHEMBL3577264)
Show SMILES CCCCCCCOc1cccc(CCC(=O)OC[C@@H](O)COP(O)(=O)O[C@@H](C)[C@H](N)C(O)=O)c1 |r|
Show InChI InChI=1S/C23H38NO10P/c1-3-4-5-6-7-13-31-20-10-8-9-18(14-20)11-12-21(26)32-15-19(25)16-33-35(29,30)34-17(2)22(24)23(27)28/h8-10,14,17,19,22,25H,3-7,11-13,15-16,24H2,1-2H3,(H,27,28)(H,29,30)/t17-,19+,22-/m0/s1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>1.00E+3n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at P2Y10 (unknown origin) transfected in HEK293A cells after 1 hr by TGFalpha shedding assay


J Med Chem 58: 4204-19 (2015)


Article DOI: 10.1021/jm5020082
BindingDB Entry DOI: 10.7270/Q2Q81FTD
More data for this
Ligand-Target Pair