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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Somatostatin receptor type 3' and Ligand = 'BDBM50110459'   
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
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110459
PNG
(CHEMBL3605787)
Show SMILES Cc1ccc(cc1)-c1c[nH]c(n1)C1(CCNCC1)NCc1c[nH]c2ccccc12
Show InChI InChI=1S/C24H27N5/c1-17-6-8-18(9-7-17)22-16-27-23(29-22)24(10-12-25-13-11-24)28-15-19-14-26-21-5-3-2-4-20(19)21/h2-9,14,16,25-26,28H,10-13,15H2,1H3,(H,27,29)
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UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
60n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS-14 from human SSTR3 expressed in CHO cells after 60 to 90 mins


Bioorg Med Chem Lett 25: 3520-5 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.087
BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110459
PNG
(CHEMBL3605787)
Show SMILES Cc1ccc(cc1)-c1c[nH]c(n1)C1(CCNCC1)NCc1c[nH]c2ccccc12
Show InChI InChI=1S/C24H27N5/c1-17-6-8-18(9-7-17)22-16-27-23(29-22)24(10-12-25-13-11-24)28-15-19-14-26-21-5-3-2-4-20(19)21/h2-9,14,16,25-26,28H,10-13,15H2,1H3,(H,27,29)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 2.50E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human SSTR3 expressed in CHO cells assessed as intracellular cAMP level after 45 mins by time-resolved fluorescence assay


Bioorg Med Chem Lett 25: 3520-5 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.087
BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair