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1 similar compounds to monomer 88892

Compile data set for download or QSAR
Wt: 592.6
BDBM61076

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 61076   
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
Apelin receptor


(Homo sapiens (Human))
BDBM61076
PNG
(MLS000408840 | N-(2,4-dimethylphenyl)-2-[2-[(2-mor...)
Show SMILES Cc1ccc(NS(=O)(=O)c2cc(ccc2N=NCc2sc(nc2-c2ccccc2)N2CCOCC2)[N+]([O-])=O)c(C)c1
Show InChI InChI=1S/C28H28N6O5S2/c1-19-8-10-23(20(2)16-19)32-41(37,38)26-17-22(34(35)36)9-11-24(26)31-29-18-25-27(21-6-4-3-5-7-21)30-28(40-25)33-12-14-39-15-13-33/h3-11,16-17,32H,12-15,18H2,1-2H3
PDB

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KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>4.00E+4n/an/an/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford- Sanford-Burnham Medical Research Institute(SBMRI, San...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MK6BBZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 55


(Homo sapiens (Human))
BDBM61076
PNG
(MLS000408840 | N-(2,4-dimethylphenyl)-2-[2-[(2-mor...)
Show SMILES Cc1ccc(NS(=O)(=O)c2cc(ccc2N=NCc2sc(nc2-c2ccccc2)N2CCOCC2)[N+]([O-])=O)c(C)c1
Show InChI InChI=1S/C28H28N6O5S2/c1-19-8-10-23(20(2)16-19)32-41(37,38)26-17-22(34(35)36)9-11-24(26)31-29-18-25-27(21-6-4-3-5-7-21)30-28(40-25)33-12-14-39-15-13-33/h3-11,16-17,32H,12-15,18H2,1-2H3
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 500n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GF0RZ3
More data for this
Ligand-Target Pair