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BDBM50358656 CHEMBL1921997

SMILES: COc1ccc(Nc2cc(Nc3ccc(OC(F)(F)F)cc3)nc(NC3CCCCC3)n2)cc1

InChI Key: InChIKey=JGQRXQSWNBCFIU-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50358656   
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
Galanin receptor 2


(Homo sapiens (Human))
BDBM50358656
PNG
(CHEMBL1921997)
Show SMILES COc1ccc(Nc2cc(Nc3ccc(OC(F)(F)F)cc3)nc(NC3CCCCC3)n2)cc1
Show InChI InChI=1S/C24H26F3N5O2/c1-33-19-11-7-17(8-12-19)28-21-15-22(32-23(31-21)30-16-5-3-2-4-6-16)29-18-9-13-20(14-10-18)34-24(25,26)27/h7-16H,2-6H2,1H3,(H3,28,29,30,31,32)
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UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.06E+3n/an/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]galanin from GalR2 by gamma counting


Bioorg Med Chem Lett 21: 7210-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.09.033
BindingDB Entry DOI: 10.7270/Q2JS9QVT
More data for this
Ligand-Target Pair
GALR1


(Homo sapiens (Human))
BDBM50358656
PNG
(CHEMBL1921997)
Show SMILES COc1ccc(Nc2cc(Nc3ccc(OC(F)(F)F)cc3)nc(NC3CCCCC3)n2)cc1
Show InChI InChI=1S/C24H26F3N5O2/c1-33-19-11-7-17(8-12-19)28-21-15-22(32-23(31-21)30-16-5-3-2-4-6-16)29-18-9-13-20(14-10-18)34-24(25,26)27/h7-16H,2-6H2,1H3,(H3,28,29,30,31,32)
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.93E+3n/an/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]galanin from GalR1 by gamma counting


Bioorg Med Chem Lett 21: 7210-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.09.033
BindingDB Entry DOI: 10.7270/Q2JS9QVT
More data for this
Ligand-Target Pair