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BDBM95252 MLS000529842::N-[2-(2-methyl-1-indolyl)ethyl]cyclohexanecarboxamide::N-[2-(2-methylindol-1-yl)ethyl]cyclohexanecarboxamide::SMR000126894::cid_3641859

SMILES: Cc1cc2ccccc2n1CCNC(=O)C1CCCCC1

InChI Key: InChIKey=XGVRPQDHOVUGQI-UHFFFAOYSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 95252   
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
Envelope glycoprotein gp160


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM95252
PNG
(MLS000529842 | N-[2-(2-methyl-1-indolyl)ethyl]cycl...)
Show SMILES Cc1cc2ccccc2n1CCNC(=O)C1CCCCC1
Show InChI InChI=1S/C18H24N2O/c1-14-13-16-9-5-6-10-17(16)20(14)12-11-19-18(21)15-7-3-2-4-8-15/h5-6,9-10,13,15H,2-4,7-8,11-12H2,1H3,(H,19,21)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

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PCBioAssay
n/an/a 2.37E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2KD1WJB
More data for this
Ligand-Target Pair
Envelope glycoprotein gp160


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM95252
PNG
(MLS000529842 | N-[2-(2-methyl-1-indolyl)ethyl]cycl...)
Show SMILES Cc1cc2ccccc2n1CCNC(=O)C1CCCCC1
Show InChI InChI=1S/C18H24N2O/c1-14-13-16-9-5-6-10-17(16)20(14)12-11-19-18(21)15-7-3-2-4-8-15/h5-6,9-10,13,15H,2-4,7-8,11-12H2,1H3,(H,19,21)
PDB

UniProtKB/SwissProt

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AffyNet 
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PC cid
PC sid
UniChem

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PCBioAssay
n/an/a 1.80E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q29W0D3P
More data for this
Ligand-Target Pair
Envelope glycoprotein gp160


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM95252
PNG
(MLS000529842 | N-[2-(2-methyl-1-indolyl)ethyl]cycl...)
Show SMILES Cc1cc2ccccc2n1CCNC(=O)C1CCCCC1
Show InChI InChI=1S/C18H24N2O/c1-14-13-16-9-5-6-10-17(16)20(14)12-11-19-18(21)15-7-3-2-4-8-15/h5-6,9-10,13,15H,2-4,7-8,11-12H2,1H3,(H,19,21)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.75E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2FN14T0
More data for this
Ligand-Target Pair