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BDBM95355 4-((E)-{[(4-{[(2E)-2-(4-carboxybenzylidene)hydrazino]carbonyl}-3,5-dimethyl-1H-pyrrol-2-yl)carbonyl]hydrazono}methyl)benzoic acid::4-[(E)-[[5-[[(E)-(4-carboxybenzylidene)amino]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carbonyl]hydrazono]methyl]benzoic acid::4-[(E)-[[5-[[(E)-(4-carboxyphenyl)methylideneamino]carbamoyl]-2,4-dimethyl-1H-pyrrol-3-yl]carbonylhydrazinylidene]methyl]benzoic acid::4-[(E)-[[5-[[(E)-(4-carboxyphenyl)methylideneamino]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carbonyl]hydrazinylidene]methyl]benzoic acid::4-[(E)-[[[5-[[(2E)-2-[(4-carboxyphenyl)methylidene]hydrazinyl]-oxomethyl]-2,4-dimethyl-1H-pyrrol-3-yl]-oxomethyl]hydrazinylidene]methyl]benzoic acid::MLS000585851::SMR000207632::cid_20846810

SMILES: Cc1[nH]c(C(=O)N\N=C\c2ccc(cc2)C(O)=O)c(C)c1C(=O)N\N=C\c1ccc(cc1)C(O)=O

InChI Key: InChIKey=CZZOVTKKHKQHJV-KOZSXFMUSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 95355   
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
MSRA protein


(Bos taurus)
BDBM95355
PNG
(4-((E)-{[(4-{[(2E)-2-(4-carboxybenzylidene)hydrazi...)
Show SMILES Cc1[nH]c(C(=O)N\N=C\c2ccc(cc2)C(O)=O)c(C)c1C(=O)N\N=C\c1ccc(cc1)C(O)=O
Show InChI InChI=1S/C24H21N5O6/c1-13-19(21(30)28-25-11-15-3-7-17(8-4-15)23(32)33)14(2)27-20(13)22(31)29-26-12-16-5-9-18(10-6-16)24(34)35/h3-12,27H,1-2H3,(H,28,30)(H,29,31)(H,32,33)(H,34,35)/b25-11+,26-12+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.14E+5n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2639NCQ
More data for this
Ligand-Target Pair