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BDBM75945 3-[4-chloranyl-5-(4-methoxyphenoxy)-6-oxidanylidene-pyridazin-1-yl]benzenecarbonitrile::3-[4-chloro-5-(4-methoxyphenoxy)-6-oxo-1-pyridazinyl]benzonitrile::3-[4-chloro-5-(4-methoxyphenoxy)-6-oxopyridazin-1-yl]benzonitrile::3-[4-chloro-6-keto-5-(4-methoxyphenoxy)pyridazin-1-yl]benzonitrile::SR-02000000481::SR-02000000481-1::cid_46850887

SMILES: COc1ccc(Oc2c(Cl)cnn(-c3cccc(c3)C#N)c2=O)cc1

InChI Key: InChIKey=OALLKBJEWKCNMP-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 75945   
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
Neuropeptides B/W receptor type 1


(Homo sapiens (Human))
BDBM75945
PNG
(3-[4-chloranyl-5-(4-methoxyphenoxy)-6-oxidanyliden...)
Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3cccc(c3)C#N)c2=O)cc1
Show InChI InChI=1S/C18H12ClN3O3/c1-24-14-5-7-15(8-6-14)25-17-16(19)11-21-22(18(17)23)13-4-2-3-12(9-13)10-20/h2-9,11H,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.80E+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 (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GB22HQ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM75945
PNG
(3-[4-chloranyl-5-(4-methoxyphenoxy)-6-oxidanyliden...)
Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3cccc(c3)C#N)c2=O)cc1
Show InChI InChI=1S/C18H12ClN3O3/c1-24-14-5-7-15(8-6-14)25-17-16(19)11-21-22(18(17)23)13-4-2-3-12(9-13)10-20/h2-9,11H,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.42E+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 (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2M32T72
More data for this
Ligand-Target Pair