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BDBM50243721 1-anilinonaphthalene-8-sulfonic acid::CHEMBL471741

SMILES: OS(=O)(=O)Oc1cccc2cccc(Nc3ccccc3)c12

InChI Key: InChIKey=XCXVLPCQWWFEQW-UHFFFAOYSA-N

Data: 2 KI  1 Kd

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 3 hits for monomerid = 50243721   
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
Liver fatty acid binding protein (rat L-FABP)


(Rattus norvegicus (Rat))
BDBM50243721
PNG
(1-anilinonaphthalene-8-sulfonic acid | CHEMBL47174...)
Show SMILES OS(=O)(=O)Oc1cccc2cccc(Nc3ccccc3)c12
Show InChI InChI=1S/C16H13NO4S/c18-22(19,20)21-15-11-5-7-12-6-4-10-14(16(12)15)17-13-8-2-1-3-9-13/h1-11,17H,(H,18,19,20)
PDB
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Article
PubMed
1.10E+3n/an/an/an/an/an/an/an/a



Monash University (Parkville Campus)

Curated by ChEMBL


Assay Description
Displacement of 1-anilinonaphthalene-8-sulphonic acid from rat recombinant L-FABP high binding affinity site expressed in Escherichia coli BL21 by co...


J Med Chem 51: 3755-64 (2008)


Article DOI: 10.1021/jm701192w
BindingDB Entry DOI: 10.7270/Q2KH0P7G
More data for this
Ligand-Target Pair
Liver fatty acid binding protein (rat L-FABP)


(Rattus norvegicus (Rat))
BDBM50243721
PNG
(1-anilinonaphthalene-8-sulfonic acid | CHEMBL47174...)
Show SMILES OS(=O)(=O)Oc1cccc2cccc(Nc3ccccc3)c12
Show InChI InChI=1S/C16H13NO4S/c18-22(19,20)21-15-11-5-7-12-6-4-10-14(16(12)15)17-13-8-2-1-3-9-13/h1-11,17H,(H,18,19,20)
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UniChem

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Article
PubMed
1.20E+4n/an/an/an/an/an/an/an/a



Monash University (Parkville Campus)

Curated by ChEMBL


Assay Description
Displacement of 1-anilinonaphthalene-8-sulphonic acid from rat recombinant L-FABP low binding affinity site expressed in Escherichia coli BL21 by com...


J Med Chem 51: 3755-64 (2008)


Article DOI: 10.1021/jm701192w
BindingDB Entry DOI: 10.7270/Q2KH0P7G
More data for this
Ligand-Target Pair
Liver fatty acid binding protein (human L-FABP T94T)


(Homo sapiens (Human))
BDBM50243721
PNG
(1-anilinonaphthalene-8-sulfonic acid | CHEMBL47174...)
Show SMILES OS(=O)(=O)Oc1cccc2cccc(Nc3ccccc3)c12
Show InChI InChI=1S/C16H13NO4S/c18-22(19,20)21-15-11-5-7-12-6-4-10-14(16(12)15)17-13-8-2-1-3-9-13/h1-11,17H,(H,18,19,20)
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Article
PubMed
n/an/an/a 2.00E+3n/an/an/an/an/a



Monash University (Parkville Campus)

Curated by ChEMBL


Assay Description
Binding affinity to human L-FABP


J Med Chem 51: 3755-64 (2008)


Article DOI: 10.1021/jm701192w
BindingDB Entry DOI: 10.7270/Q2KH0P7G
More data for this
Ligand-Target Pair