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BDBM50397852 CHEMBL2179510

SMILES: Cc1noc(n1)-c1ccc2n(CCCSc3cc(F)cc(F)c3)c3CCCCc3c2c1

InChI Key: InChIKey=GZGZYDZBSNEDTO-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50397852   
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
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50397852
PNG
(CHEMBL2179510)
Show SMILES Cc1noc(n1)-c1ccc2n(CCCSc3cc(F)cc(F)c3)c3CCCCc3c2c1
Show InChI InChI=1S/C24H23F2N3OS/c1-15-27-24(30-28-15)16-7-8-23-21(11-16)20-5-2-3-6-22(20)29(23)9-4-10-31-19-13-17(25)12-18(26)14-19/h7-8,11-14H,2-6,9-10H2,1H3
PDB
MMDB

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PC cid
PC sid
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Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human ERG


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
Scavenger receptor class B member 1


(Homo sapiens (Human))
BDBM50397852
PNG
(CHEMBL2179510)
Show SMILES Cc1noc(n1)-c1ccc2n(CCCSc3cc(F)cc(F)c3)c3CCCCc3c2c1
Show InChI InChI=1S/C24H23F2N3OS/c1-15-27-24(30-28-15)16-7-8-23-21(11-16)20-5-2-3-6-22(20)29(23)9-4-10-31-19-13-17(25)12-18(26)14-19/h7-8,11-14H,2-6,9-10H2,1H3
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.5n/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
Scavenger receptor class B member 1


(Homo sapiens (Human))
BDBM50397852
PNG
(CHEMBL2179510)
Show SMILES Cc1noc(n1)-c1ccc2n(CCCSc3cc(F)cc(F)c3)c3CCCCc3c2c1
Show InChI InChI=1S/C24H23F2N3OS/c1-15-27-24(30-28-15)16-7-8-23-21(11-16)20-5-2-3-6-22(20)29(23)9-4-10-31-19-13-17(25)12-18(26)14-19/h7-8,11-14H,2-6,9-10H2,1H3
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.5n/an/an/an/an/an/a



iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 1a entry into human HuH7.5 cells by immunoblotting


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