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3 similar compounds to monomer 50149565

Compile data set for download or QSAR
Wt: 430.4
BDBM50149547
Wt: 430.4
BDBM50149549
Wt: 378.3
BDBM50149552

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50149547,50149549,50149552   
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
Homeobox protein Brn-2


(Homo sapiens (Human))
BDBM50149547
PNG
(4-[(4-Hydroxy-phenylcarbamoyl)-methoxy]-naphthalen...)
Show SMILES Oc1ccc(NC(=O)COc2ccc(C(=O)Nc3cccc(F)c3)c3ccccc23)cc1
Show InChI InChI=1S/C25H19FN2O4/c26-16-4-3-5-18(14-16)28-25(31)22-12-13-23(21-7-2-1-6-20(21)22)32-15-24(30)27-17-8-10-19(29)11-9-17/h1-14,29H,15H2,(H,27,30)(H,28,31)
PDB
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GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 1.38E+5n/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Antagonistic activity against BRN2/DNA interaction by electrophoretic mobility shift assay


Bioorg Med Chem Lett 14: 3875-9 (2004)


Article DOI: 10.1016/j.bmcl.2004.05.068
BindingDB Entry DOI: 10.7270/Q2ZS2VZW
More data for this
Ligand-Target Pair
Homeobox protein Brn-2


(Homo sapiens (Human))
BDBM50149549
PNG
(4-[(3-Hydroxy-phenylcarbamoyl)-methoxy]-naphthalen...)
Show SMILES Oc1cccc(NC(=O)COc2ccc(C(=O)Nc3cccc(F)c3)c3ccccc23)c1
Show InChI InChI=1S/C25H19FN2O4/c26-16-5-3-6-17(13-16)28-25(31)22-11-12-23(21-10-2-1-9-20(21)22)32-15-24(30)27-18-7-4-8-19(29)14-18/h1-14,29H,15H2,(H,27,30)(H,28,31)
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GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 1.48E+5n/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Antagonistic activity against BRN2/DNA interaction by electrophoretic mobility shift assay


Bioorg Med Chem Lett 14: 3875-9 (2004)


Article DOI: 10.1016/j.bmcl.2004.05.068
BindingDB Entry DOI: 10.7270/Q2ZS2VZW
More data for this
Ligand-Target Pair
Homeobox protein Brn-1


(Homo sapiens (Human))
BDBM50149549
PNG
(4-[(3-Hydroxy-phenylcarbamoyl)-methoxy]-naphthalen...)
Show SMILES Oc1cccc(NC(=O)COc2ccc(C(=O)Nc3cccc(F)c3)c3ccccc23)c1
Show InChI InChI=1S/C25H19FN2O4/c26-16-5-3-6-17(13-16)28-25(31)22-11-12-23(21-10-2-1-9-20(21)22)32-15-24(30)27-18-7-4-8-19(29)14-18/h1-14,29H,15H2,(H,27,30)(H,28,31)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.42E+5n/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Antagonistic activity against BRN1/DNA interaction by electrophoretic mobility shift assay


Bioorg Med Chem Lett 14: 3875-9 (2004)


Article DOI: 10.1016/j.bmcl.2004.05.068
BindingDB Entry DOI: 10.7270/Q2ZS2VZW
More data for this
Ligand-Target Pair
Homeobox protein Brn-1


(Homo sapiens (Human))
BDBM50149547
PNG
(4-[(4-Hydroxy-phenylcarbamoyl)-methoxy]-naphthalen...)
Show SMILES Oc1ccc(NC(=O)COc2ccc(C(=O)Nc3cccc(F)c3)c3ccccc23)cc1
Show InChI InChI=1S/C25H19FN2O4/c26-16-4-3-5-18(14-16)28-25(31)22-12-13-23(21-7-2-1-6-20(21)22)32-15-24(30)27-17-8-10-19(29)11-9-17/h1-14,29H,15H2,(H,27,30)(H,28,31)
PDB
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KEGG

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Article
PubMed
n/an/a 1.24E+5n/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Antagonistic activity against BRN1/DNA interaction by electrophoretic mobility shift assay


Bioorg Med Chem Lett 14: 3875-9 (2004)


Article DOI: 10.1016/j.bmcl.2004.05.068
BindingDB Entry DOI: 10.7270/Q2ZS2VZW
More data for this
Ligand-Target Pair
Homeobox protein Brn-2


(Homo sapiens (Human))
BDBM50149552
PNG
(4-Cyclopropylcarbamoylmethoxy-naphthalene-1-carbox...)
Show SMILES Fc1cccc(NC(=O)c2ccc(OCC(=O)NC3CC3)c3ccccc23)c1
Show InChI InChI=1S/C22H19FN2O3/c23-14-4-3-5-16(12-14)25-22(27)19-10-11-20(18-7-2-1-6-17(18)19)28-13-21(26)24-15-8-9-15/h1-7,10-12,15H,8-9,13H2,(H,24,26)(H,25,27)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+7n/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Antagonistic activity against BRN2/DNA interaction by electrophoretic mobility shift assay


Bioorg Med Chem Lett 14: 3875-9 (2004)


Article DOI: 10.1016/j.bmcl.2004.05.068
BindingDB Entry DOI: 10.7270/Q2ZS2VZW
More data for this
Ligand-Target Pair
Homeobox protein Brn-1


(Homo sapiens (Human))
BDBM50149552
PNG
(4-Cyclopropylcarbamoylmethoxy-naphthalene-1-carbox...)
Show SMILES Fc1cccc(NC(=O)c2ccc(OCC(=O)NC3CC3)c3ccccc23)c1
Show InChI InChI=1S/C22H19FN2O3/c23-14-4-3-5-16(12-14)25-22(27)19-10-11-20(18-7-2-1-6-17(18)19)28-13-21(26)24-15-8-9-15/h1-7,10-12,15H,8-9,13H2,(H,24,26)(H,25,27)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 8.10E+5n/an/an/an/an/an/a



The State University of New York

Curated by ChEMBL


Assay Description
Antagonistic activity against BRN1/DNA interaction by electrophoretic mobility shift assay


Bioorg Med Chem Lett 14: 3875-9 (2004)


Article DOI: 10.1016/j.bmcl.2004.05.068
BindingDB Entry DOI: 10.7270/Q2ZS2VZW
More data for this
Ligand-Target Pair