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BDBM75947 5-chloranyl-4-(4-methoxyphenoxy)-2-(3-methoxyphenyl)pyridazin-3-one::5-chloro-4-(4-methoxyphenoxy)-2-(3-methoxyphenyl)-3-pyridazinone::5-chloro-4-(4-methoxyphenoxy)-2-(3-methoxyphenyl)pyridazin-3-one::SR-02000000483::SR-02000000483-1::cid_46850891

SMILES: COc1ccc(Oc2c(Cl)cnn(-c3cccc(OC)c3)c2=O)cc1

InChI Key: InChIKey=AKNGGPYBXULRJE-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 = 75947   
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
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM75947
PNG
(5-chloranyl-4-(4-methoxyphenoxy)-2-(3-methoxypheny...)
Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3cccc(OC)c3)c2=O)cc1
Show InChI InChI=1S/C18H15ClN2O4/c1-23-13-6-8-14(9-7-13)25-17-16(19)11-20-21(18(17)22)12-4-3-5-15(10-12)24-2/h3-11H,1-2H3
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KEGG

UniProtKB/SwissProt

antibodypedia
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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 3.40E+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/Q2M32T72
More data for this
Ligand-Target Pair
Neuropeptides B/W receptor type 1


(Homo sapiens (Human))
BDBM75947
PNG
(5-chloranyl-4-(4-methoxyphenoxy)-2-(3-methoxypheny...)
Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3cccc(OC)c3)c2=O)cc1
Show InChI InChI=1S/C18H15ClN2O4/c1-23-13-6-8-14(9-7-13)25-17-16(19)11-20-21(18(17)22)12-4-3-5-15(10-12)24-2/h3-11H,1-2H3
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KEGG

UniProtKB/SwissProt

antibodypedia
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UniChem

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Article
PubMed
n/an/a 410n/an/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human NPBWR1 expressed in HEK293T cells co-expressing Galphaqi3 assessed as calcium release after 15 mins by FLIPR assay assay


Bioorg Med Chem Lett 22: 7135-41 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.074
BindingDB Entry DOI: 10.7270/Q2WS8VDC
More data for this
Ligand-Target Pair
Neuropeptides B/W receptor type 1


(Homo sapiens (Human))
BDBM75947
PNG
(5-chloranyl-4-(4-methoxyphenoxy)-2-(3-methoxypheny...)
Show SMILES COc1ccc(Oc2c(Cl)cnn(-c3cccc(OC)c3)c2=O)cc1
Show InChI InChI=1S/C18H15ClN2O4/c1-23-13-6-8-14(9-7-13)25-17-16(19)11-20-21(18(17)22)12-4-3-5-15(10-12)24-2/h3-11H,1-2H3
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 410n/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