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SMILES: Cc1ccc2c(Cl)c(Cc3ccccc3)c(=S)[nH]c2n1

InChI Key: InChIKey=KRGULNTWJREXFU-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 2 hits for monomerid = 83394   
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
Methyl-CpG-binding domain protein 2


(Homo sapiens (Human))
BDBM83394
PNG
(3-benzyl-4-chloro-7-methyl-1H-1,8-naphthyridine-2-...)
Show SMILES Cc1ccc2c(Cl)c(Cc3ccccc3)c(=S)[nH]c2n1
Show InChI InChI=1S/C16H13ClN2S/c1-10-7-8-12-14(17)13(16(20)19-15(12)18-10)9-11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H,18,19,20)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 8.02E+3n/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: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q20K2778
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM83394
PNG
(3-benzyl-4-chloro-7-methyl-1H-1,8-naphthyridine-2-...)
Show SMILES Cc1ccc2c(Cl)c(Cc3ccccc3)c(=S)[nH]c2n1
Show InChI InChI=1S/C16H13ClN2S/c1-10-7-8-12-14(17)13(16(20)19-15(12)18-10)9-11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H,18,19,20)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a>9.25E+4n/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 (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q22V2DN3
More data for this
Ligand-Target Pair