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SMILES: N#Cc1cc2ccccc2nc1SCc1ccccn1

InChI Key: InChIKey=ZSDAMVTUFIDYFC-UHFFFAOYSA-N

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 = 49189   
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
Transcription factor p65


(Homo sapiens (Human))
BDBM49189
PNG
(2-(2-pyridinylmethylthio)-3-quinolinecarbonitrile ...)
Show SMILES N#Cc1cc2ccccc2nc1SCc1ccccn1
Show InChI InChI=1S/C16H11N3S/c17-10-13-9-12-5-1-2-7-15(12)19-16(13)20-11-14-6-3-4-8-18-14/h1-9H,11H2
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 1.51E+5n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Nuclear hormone receptor family member daf-12


(Caenorhabditis elegans)
BDBM49189
PNG
(2-(2-pyridinylmethylthio)-3-quinolinecarbonitrile ...)
Show SMILES N#Cc1cc2ccccc2nc1SCc1ccccn1
Show InChI InChI=1S/C16H11N3S/c17-10-13-9-12-5-1-2-7-15(12)19-16(13)20-11-14-6-3-4-8-18-14/h1-9H,11H2
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 6.75E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: UT Southwestern Assay Provider: David Mangelsdorf,...


PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2736PK0
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))
BDBM49189
PNG
(2-(2-pyridinylmethylthio)-3-quinolinecarbonitrile ...)
Show SMILES N#Cc1cc2ccccc2nc1SCc1ccccn1
Show InChI InChI=1S/C16H11N3S/c17-10-13-9-12-5-1-2-7-15(12)19-16(13)20-11-14-6-3-4-8-18-14/h1-9H,11H2
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 6.75E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: UT Southwestern Assay Provider: David Mangelsdorf,...


PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2TX3D2C
More data for this
Ligand-Target Pair