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BDBM50397865 CHEMBL2179506

SMILES: CCCc1cn(nn1)-c1ccc2n(CCCOc3nc(CC)cc(CC)n3)c3CCCCc3c2c1

InChI Key: InChIKey=BNTIUYOSOQHQAQ-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50397865   
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
Scavenger receptor class B member 1


(Homo sapiens (Human))
BDBM50397865
PNG
(CHEMBL2179506)
Show SMILES CCCc1cn(nn1)-c1ccc2n(CCCOc3nc(CC)cc(CC)n3)c3CCCCc3c2c1
Show InChI InChI=1S/C28H36N6O/c1-4-10-22-19-34(32-31-22)23-13-14-27-25(18-23)24-11-7-8-12-26(24)33(27)15-9-16-35-28-29-20(5-2)17-21(6-3)30-28/h13-14,17-19H,4-12,15-16H2,1-3H3
KEGG

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 15n/an/an/an/an/an/a



iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay


Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair