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BDBM50110478 CHEMBL3605806

SMILES: Cc1ccc(cc1)-c1c[nH]c(n1)C1(CCCC1)NCc1cccc(F)c1

InChI Key: InChIKey=JUPSXCNVLALBFD-UHFFFAOYSA-N

Data: 1 KI  1 EC50

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 = 50110478   
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
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110478
PNG
(CHEMBL3605806)
Show SMILES Cc1ccc(cc1)-c1c[nH]c(n1)C1(CCCC1)NCc1cccc(F)c1
Show InChI InChI=1S/C22H24FN3/c1-16-7-9-18(10-8-16)20-15-24-21(26-20)22(11-2-3-12-22)25-14-17-5-4-6-19(23)13-17/h4-10,13,15,25H,2-3,11-12,14H2,1H3,(H,24,26)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
72n/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)


BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110478
PNG
(CHEMBL3605806)
Show SMILES Cc1ccc(cc1)-c1c[nH]c(n1)C1(CCCC1)NCc1cccc(F)c1
Show InChI InChI=1S/C22H24FN3/c1-16-7-9-18(10-8-16)20-15-24-21(26-20)22(11-2-3-12-22)25-14-17-5-4-6-19(23)13-17/h4-10,13,15,25H,2-3,11-12,14H2,1H3,(H,24,26)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/an/an/a 93n/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)


BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair