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BDBM50169476 4-{3-(4-Ethyl-phenyl)-5-[2-(1H-indol-3-yl)-ethylsulfanyl]-[1,2,4]triazol-4-yl}-butylamine::CHEMBL365627

SMILES: CCc1ccc(cc1)-c1nnc(SCCc2c[nH]c3ccccc23)n1CCCCN

InChI Key: InChIKey=YKFZRNVBSDILEH-UHFFFAOYSA-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 = 50169476   
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 5


(Homo sapiens (Human))
BDBM50169476
PNG
(4-{3-(4-Ethyl-phenyl)-5-[2-(1H-indol-3-yl)-ethylsu...)
Show SMILES CCc1ccc(cc1)-c1nnc(SCCc2c[nH]c3ccccc23)n1CCCCN
Show InChI InChI=1S/C24H29N5S/c1-2-18-9-11-19(12-10-18)23-27-28-24(29(23)15-6-5-14-25)30-16-13-20-17-26-22-8-4-3-7-21(20)22/h3-4,7-12,17,26H,2,5-6,13-16,25H2,1H3
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KEGG

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PC cid
PC sid
UniChem

Similars

Article
PubMed
26n/an/an/an/an/an/an/an/a



Institut Henri Beaufour

Curated by ChEMBL


Assay Description
Inhibitory constant against human sst5 receptor at a dose of 10 uM


Bioorg Med Chem Lett 15: 3555-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.061
BindingDB Entry DOI: 10.7270/Q2W66MH6
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(Homo sapiens (Human))
BDBM50169476
PNG
(4-{3-(4-Ethyl-phenyl)-5-[2-(1H-indol-3-yl)-ethylsu...)
Show SMILES CCc1ccc(cc1)-c1nnc(SCCc2c[nH]c3ccccc23)n1CCCCN
Show InChI InChI=1S/C24H29N5S/c1-2-18-9-11-19(12-10-18)23-27-28-24(29(23)15-6-5-14-25)30-16-13-20-17-26-22-8-4-3-7-21(20)22/h3-4,7-12,17,26H,2,5-6,13-16,25H2,1H3
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
430n/an/an/an/an/an/an/an/a



Institut Henri Beaufour

Curated by ChEMBL


Assay Description
Inhibitory constant against human sst2 receptor at a dose of 10 uM


Bioorg Med Chem Lett 15: 3555-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.061
BindingDB Entry DOI: 10.7270/Q2W66MH6
More data for this
Ligand-Target Pair