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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Putative P2Y purinoceptor 10' and Ligand = 'BDBM50096438'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Putative P2Y purinoceptor 10


(Homo sapiens (Human))
BDBM50096438
PNG
(CHEMBL3577167)
Show SMILES CCCCCCCOc1ccccc1CCC(=O)OC[C@@H](O)COP(O)(=O)OC[C@H](N)C(O)=O |r|
Show InChI InChI=1S/C22H36NO10P/c1-2-3-4-5-8-13-30-20-10-7-6-9-17(20)11-12-21(25)31-14-18(24)15-32-34(28,29)33-16-19(23)22(26)27/h6-7,9-10,18-19,24H,2-5,8,11-16,23H2,1H3,(H,26,27)(H,28,29)/t18-,19+/m1/s1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 120n/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
Putative P2Y purinoceptor 10


(Homo sapiens (Human))
BDBM50096438
PNG
(CHEMBL3577167)
Show SMILES CCCCCCCOc1ccccc1CCC(=O)OC[C@@H](O)COP(O)(=O)OC[C@H](N)C(O)=O |r|
Show InChI InChI=1S/C22H36NO10P/c1-2-3-4-5-8-13-30-20-10-7-6-9-17(20)11-12-21(25)31-14-18(24)15-32-34(28,29)33-16-19(23)22(26)27/h6-7,9-10,18-19,24H,2-5,8,11-16,23H2,1H3,(H,26,27)(H,28,29)/t18-,19+/m1/s1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 123n/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