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3 similar compounds to monomer 61860

Compile data set for download or QSAR
Wt: 281.2
BDBM51268
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Wt: 403.3
BDBM79543
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Wt: 373.3
BDBM79414
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 51268,79543,79414   
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
BZLF2


(Human herpesvirus 4 type 2)
BDBM51268
PNG
(Acetic acid 3-oxo-2-[1-pyridin-4-yl-meth-(Z)-ylide...)
Show SMILES CC(=O)Oc1ccc2C(=O)\C(Oc2c1)=C\c1ccncc1
Show InChI InChI=1S/C16H11NO4/c1-10(18)20-12-2-3-13-14(9-12)21-15(16(13)19)8-11-4-6-17-7-5-11/h2-9H,1H3/b15-8-
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
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PC sid
UniChem

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PCBioAssay
n/an/a 3.68E+3n/an/an/an/an/an/a



Emory University Molecular Libraries Screening Center

Curated by PubChem BioAssay


Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Theodore Jardetzky; Northw...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2057DCW
More data for this
Ligand-Target Pair
Dopamine receptor D2L/neurotensin receptor NTS1


(Homo sapiens (Human))
BDBM79543
PNG
(2,6-Dimethoxy-benzoic acid 3-oxo-2-[1-pyridin-4-yl...)
Show SMILES COc1cccc(OC)c1C(=O)Oc1ccc2C(=O)\C(Oc2c1)=C\c1ccncc1
Show InChI InChI=1S/C23H17NO6/c1-27-17-4-3-5-18(28-2)21(17)23(26)29-15-6-7-16-19(13-15)30-20(22(16)25)12-14-8-10-24-11-9-14/h3-13H,1-2H3/b20-12-
PDB

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PCBioAssay
n/an/an/an/a 1.59E+4n/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 (2011)


BindingDB Entry DOI: 10.7270/Q22N50RJ
More data for this
Ligand-Target Pair
cardiac alpha tropomyosin


(Sus scrofa)
BDBM79414
PNG
(2-Methoxy-benzoic acid 3-oxo-2-[1-pyridin-4-yl-met...)
Show SMILES COc1ccccc1C(=O)Oc1ccc2C(=O)\C(Oc2c1)=C\c1ccncc1
Show InChI InChI=1S/C22H15NO5/c1-26-18-5-3-2-4-17(18)22(25)27-15-6-7-16-19(13-15)28-20(21(16)24)12-14-8-10-23-11-9-14/h2-13H,1H3/b20-12-
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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n/an/an/an/a 1.37E+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/Q21N7ZKB
More data for this
Ligand-Target Pair
perilipin-5


(Homo sapiens (Human))
BDBM79414
PNG
(2-Methoxy-benzoic acid 3-oxo-2-[1-pyridin-4-yl-met...)
Show SMILES COc1ccccc1C(=O)Oc1ccc2C(=O)\C(Oc2c1)=C\c1ccncc1
Show InChI InChI=1S/C22H15NO5/c1-26-18-5-3-2-4-17(18)22(25)27-15-6-7-16-19(13-15)28-20(21(16)24)12-14-8-10-23-11-9-14/h2-13H,1H3/b20-12-
KEGG

UniProtKB/SwissProt

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n/an/a 8.12E+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 (2011)


BindingDB Entry DOI: 10.7270/Q2D21W3H
More data for this
Ligand-Target Pair
perilipin-1


(Homo sapiens (Human))
BDBM79414
PNG
(2-Methoxy-benzoic acid 3-oxo-2-[1-pyridin-4-yl-met...)
Show SMILES COc1ccccc1C(=O)Oc1ccc2C(=O)\C(Oc2c1)=C\c1ccncc1
Show InChI InChI=1S/C22H15NO5/c1-26-18-5-3-2-4-17(18)22(25)27-15-6-7-16-19(13-15)28-20(21(16)24)12-14-8-10-23-11-9-14/h2-13H,1H3/b20-12-
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PCBioAssay
n/an/a 6.72E+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 (2011)


BindingDB Entry DOI: 10.7270/Q2HT2MS2
More data for this
Ligand-Target Pair