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BDBM50386755 CHEMBL2046889

SMILES: C(CNCCC(c1ccccc1)c1ccccc1)Cc1ccccc1

InChI Key: InChIKey=URZOIXVPUIVTPT-UHFFFAOYSA-N

Data: 2 IC50

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 = 50386755   
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
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM50386755
PNG
(CHEMBL2046889)
Show SMILES C(CNCCC(c1ccccc1)c1ccccc1)Cc1ccccc1
Show InChI InChI=1S/C24H27N/c1-4-11-21(12-5-1)13-10-19-25-20-18-24(22-14-6-2-7-15-22)23-16-8-3-9-17-23/h1-9,11-12,14-17,24-25H,10,13,18-20H2
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 15.8n/an/an/an/an/an/a



University of Bologna

Curated by ChEMBL


Assay Description
Inhibition of human ERG expressed in HEK cells by patch clamp assay


J Med Chem 55: 4010-4 (2012)


Article DOI: 10.1021/jm201194q
BindingDB Entry DOI: 10.7270/Q2BR8T7D
More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM50386755
PNG
(CHEMBL2046889)
Show SMILES C(CNCCC(c1ccccc1)c1ccccc1)Cc1ccccc1
Show InChI InChI=1S/C24H27N/c1-4-11-21(12-5-1)13-10-19-25-20-18-24(22-14-6-2-7-15-22)23-16-8-3-9-17-23/h1-9,11-12,14-17,24-25H,10,13,18-20H2
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 17n/an/an/an/an/an/a



University of Bologna

Curated by ChEMBL


Assay Description
Inhibition of human ERG expressed in HEK cells by patch clamp assay


J Med Chem 55: 4010-4 (2012)


Article DOI: 10.1021/jm201194q
BindingDB Entry DOI: 10.7270/Q2BR8T7D
More data for this
Ligand-Target Pair