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BDBM48027 4-[[(4E)-1-keto-4-mesitylsulfonylimino-2-naphthyl]amino]benzoic acid::4-[[(4E)-1-oxidanylidene-4-(2,4,6-trimethylphenyl)sulfonylimino-naphthalen-2-yl]amino]benzoic acid::4-[[(4E)-1-oxo-4-(2,4,6-trimethylphenyl)sulfonylimino-2-naphthalenyl]amino]benzoic acid::4-[[(4E)-1-oxo-4-(2,4,6-trimethylphenyl)sulfonyliminonaphthalen-2-yl]amino]benzoic acid::MLS000948031::SMR000620244::cid_9609431
SMILES: Cc1cc(C)c(c(C)c1)S(=O)(=O)N=C1C=C(Nc2ccc(cc2)C(O)=O)C(=O)c2ccccc12
InChI Key: InChIKey=SQJSGUXHLPYCJY-UHFFFAOYSA-N
| Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Heat shock protein HSP 90-alpha (Human) | BDBM48027![]() (MLS000948031 | cid_9609431 | 4-[[(4E)-1-oxo-4-(2,4...) | GoogleScholar | UniChem | n/a | n/a | 1.68E+3 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Heat shock factor protein 1 (Mouse) | BDBM48027![]() (MLS000948031 | cid_9609431 | 4-[[(4E)-1-oxo-4-(2,4...) | GoogleScholar | UniChem | n/a | n/a | n/a | n/a | 6.73E+3 | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Protein RecA (Mycobacterium tuberculosis (strain ATCC 25618 / H3...) | BDBM48027![]() (MLS000948031 | cid_9609431 | 4-[[(4E)-1-oxo-4-(2,4...) | GoogleScholar | UniChem | n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Beta-galactosidase (Escherichia coli) | BDBM48027![]() (MLS000948031 | cid_9609431 | 4-[[(4E)-1-oxo-4-(2,4...) | GoogleScholar | UniChem | n/a | n/a | 3.61E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| C-C chemokine receptor type 6 (Human) | BDBM48027![]() (MLS000948031 | cid_9609431 | 4-[[(4E)-1-oxo-4-(2,4...) | GoogleScholar | UniChem | n/a | n/a | 3.04E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Hexokinase HKDC1 [W721R] (Human) | BDBM48027![]() (MLS000948031 | cid_9609431 | 4-[[(4E)-1-oxo-4-(2,4...) | GoogleScholar | UniChem | n/a | n/a | 1.52E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Hexokinase HKDC1 [W721R] (Human) | BDBM48027![]() (MLS000948031 | cid_9609431 | 4-[[(4E)-1-oxo-4-(2,4...) | GoogleScholar | UniChem | n/a | n/a | 2.73E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Apoptotic protease-activating factor 1 (Human) | BDBM48027![]() (MLS000948031 | cid_9609431 | 4-[[(4E)-1-oxo-4-(2,4...) | GoogleScholar | UniChem | n/a | n/a | 6.01E+3 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Apoptotic protease-activating factor 1 (Human) | BDBM48027![]() (MLS000948031 | cid_9609431 | 4-[[(4E)-1-oxo-4-(2,4...) | GoogleScholar | UniChem | n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Caspase-9 (Human) | BDBM48027![]() (MLS000948031 | cid_9609431 | 4-[[(4E)-1-oxo-4-(2,4...) | GoogleScholar | UniChem | n/a | n/a | 4.46E+3 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Mitochondrial peptide methionine sulfoxide reductase (Bovine) | BDBM48027![]() (MLS000948031 | cid_9609431 | 4-[[(4E)-1-oxo-4-(2,4...) | GoogleScholar | UniChem | n/a | n/a | 4.48E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||