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BDBM51315 3-[(2Z)-2-(3-formyl-4-oxo-1-cyclohexa-2,5-dienylidene)hydrazinyl]benzoic acid::3-[(2Z)-2-(3-formyl-4-oxocyclohexa-2,5-dien-1-ylidene)hydrazinyl]benzoic acid::3-[(2Z)-2-(3-methanoyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)hydrazinyl]benzoic acid::3-[(E)-(3-formyl-4-hydroxyphenyl)diazenyl]benzoic acid::3-[(N'Z)-N'-(3-formyl-4-keto-cyclohexa-2,5-dien-1-ylidene)hydrazino]benzoic acid::MLS000685416::SMR000312380::cid_6520603

SMILES: OC(=O)c1cccc(c1)N=Nc1ccc(O)c(C=O)c1

InChI Key: InChIKey=VEUVVTPWFGTPGG-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 51315   
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
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM51315
PNG
(3-[(2Z)-2-(3-formyl-4-oxo-1-cyclohexa-2,5-dienylid...)
Show SMILES OC(=O)c1cccc(c1)N=Nc1ccc(O)c(C=O)c1 |w:9.9|
Show InChI InChI=1S/C14H10N2O4/c17-8-10-7-12(4-5-13(10)18)16-15-11-3-1-2-9(6-11)14(19)20/h1-8,18H,(H,19,20)
PDB
MMDB

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KEGG

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PC sid
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PCBioAssay
n/an/a 4.25E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Project Title: A screen for modulators of human Rad51, a key DNA repair protein Application Number: MH084119 Assay Submitter: Dr. Alex Mazin Submitte...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2VD6WW6
More data for this
Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM51315
PNG
(3-[(2Z)-2-(3-formyl-4-oxo-1-cyclohexa-2,5-dienylid...)
Show SMILES OC(=O)c1cccc(c1)N=Nc1ccc(O)c(C=O)c1 |w:9.9|
Show InChI InChI=1S/C14H10N2O4/c17-8-10-7-12(4-5-13(10)18)16-15-11-3-1-2-9(6-11)14(19)20/h1-8,18H,(H,19,20)
PDB
MMDB

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KEGG

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UniChem

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PCBioAssay
n/an/a 5.09E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Project Title: A screen for modulators of human Rad51, a key DNA repair protein Application Number: MH084119 Assay Submitter: Dr. Alex Mazin Submitte...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2QN6558
More data for this
Ligand-Target Pair
Phospholipase C-beta-3


(Homo sapiens (Human))
BDBM51315
PNG
(3-[(2Z)-2-(3-formyl-4-oxo-1-cyclohexa-2,5-dienylid...)
Show SMILES OC(=O)c1cccc(c1)N=Nc1ccc(O)c(C=O)c1 |w:9.9|
Show InChI InChI=1S/C14H10N2O4/c17-8-10-7-12(4-5-13(10)18)16-15-11-3-1-2-9(6-11)14(19)20/h1-8,18H,(H,19,20)
PDB
MMDB

NCI pathway
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KEGG

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PCBioAssay
n/an/a 1.22E+5n/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) Center Affiliation: The Scripps Research Institute Ass...


PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q2S46QKQ
More data for this
Ligand-Target Pair
Phospholipase C, gamma 1


(Homo sapiens (Human))
BDBM51315
PNG
(3-[(2Z)-2-(3-formyl-4-oxo-1-cyclohexa-2,5-dienylid...)
Show SMILES OC(=O)c1cccc(c1)N=Nc1ccc(O)c(C=O)c1 |w:9.9|
Show InChI InChI=1S/C14H10N2O4/c17-8-10-7-12(4-5-13(10)18)16-15-11-3-1-2-9(6-11)14(19)20/h1-8,18H,(H,19,20)
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PCBioAssay
n/an/a 2.37E+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) Center Affiliation: The Scripps Research Institute Ass...


PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q2NC5ZV0
More data for this
Ligand-Target Pair
leucine aminopeptidase


(Plasmodium falciparum 3D7)
BDBM51315
PNG
(3-[(2Z)-2-(3-formyl-4-oxo-1-cyclohexa-2,5-dienylid...)
Show SMILES OC(=O)c1cccc(c1)N=Nc1ccc(O)c(C=O)c1 |w:9.9|
Show InChI InChI=1S/C14H10N2O4/c17-8-10-7-12(4-5-13(10)18)16-15-11-3-1-2-9(6-11)14(19)20/h1-8,18H,(H,19,20)
PDB
MMDB

KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 5.15E+4n/an/an/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q27W69N8
More data for this
Ligand-Target Pair