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BDBM50289210 4-(2-Carboxy-6-hydroxy-benzoyl)-3,5-dihydroxy-benzoic acid (S)-1-(4-hydroxy-benzoylamino)-indan-2-yl ester::CHEMBL367457

SMILES: OC(=O)c1cccc(O)c1C(=O)c1c(O)cc(cc1O)C(=O)OC1Cc2ccccc2[C@@H]1NC(=O)c1ccc(O)cc1

InChI Key: InChIKey=NNVINYYJNCKGRA-WKDCXCOVSA-N

Data: 7 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 7 hits for monomerid = 50289210   
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
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50289210
PNG
(4-(2-Carboxy-6-hydroxy-benzoyl)-3,5-dihydroxy-benz...)
Show SMILES OC(=O)c1cccc(O)c1C(=O)c1c(O)cc(cc1O)C(=O)OC1Cc2ccccc2[C@@H]1NC(=O)c1ccc(O)cc1
Show InChI InChI=1S/C31H23NO10/c33-18-10-8-15(9-11-18)29(38)32-27-19-5-2-1-4-16(19)14-24(27)42-31(41)17-12-22(35)26(23(36)13-17)28(37)25-20(30(39)40)6-3-7-21(25)34/h1-13,24,27,33-36H,14H2,(H,32,38)(H,39,40)/t24?,27-/m0/s1
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Article
n/an/a>5.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of protein kinase C alpha


Bioorg Med Chem Lett 6: 973-978 (1996)


Article DOI: 10.1016/0960-894X(96)00151-5
BindingDB Entry DOI: 10.7270/Q23B603M
More data for this
Ligand-Target Pair
Protein kinase C, gamma


(Homo sapiens (Human))
BDBM50289210
PNG
(4-(2-Carboxy-6-hydroxy-benzoyl)-3,5-dihydroxy-benz...)
Show SMILES OC(=O)c1cccc(O)c1C(=O)c1c(O)cc(cc1O)C(=O)OC1Cc2ccccc2[C@@H]1NC(=O)c1ccc(O)cc1
Show InChI InChI=1S/C31H23NO10/c33-18-10-8-15(9-11-18)29(38)32-27-19-5-2-1-4-16(19)14-24(27)42-31(41)17-12-22(35)26(23(36)13-17)28(37)25-20(30(39)40)6-3-7-21(25)34/h1-13,24,27,33-36H,14H2,(H,32,38)(H,39,40)/t24?,27-/m0/s1
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Article
n/an/a 3.40E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of protein kinase C gamma


Bioorg Med Chem Lett 6: 973-978 (1996)


Article DOI: 10.1016/0960-894X(96)00151-5
BindingDB Entry DOI: 10.7270/Q23B603M
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50289210
PNG
(4-(2-Carboxy-6-hydroxy-benzoyl)-3,5-dihydroxy-benz...)
Show SMILES OC(=O)c1cccc(O)c1C(=O)c1c(O)cc(cc1O)C(=O)OC1Cc2ccccc2[C@@H]1NC(=O)c1ccc(O)cc1
Show InChI InChI=1S/C31H23NO10/c33-18-10-8-15(9-11-18)29(38)32-27-19-5-2-1-4-16(19)14-24(27)42-31(41)17-12-22(35)26(23(36)13-17)28(37)25-20(30(39)40)6-3-7-21(25)34/h1-13,24,27,33-36H,14H2,(H,32,38)(H,39,40)/t24?,27-/m0/s1
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Article
n/an/a 2.10E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of protein kinase C delta


Bioorg Med Chem Lett 6: 973-978 (1996)


Article DOI: 10.1016/0960-894X(96)00151-5
BindingDB Entry DOI: 10.7270/Q23B603M
More data for this
Ligand-Target Pair
cAMP-dependent protein kinase (PKA)


(Homo sapiens (Human))
BDBM50289210
PNG
(4-(2-Carboxy-6-hydroxy-benzoyl)-3,5-dihydroxy-benz...)
Show SMILES OC(=O)c1cccc(O)c1C(=O)c1c(O)cc(cc1O)C(=O)OC1Cc2ccccc2[C@@H]1NC(=O)c1ccc(O)cc1
Show InChI InChI=1S/C31H23NO10/c33-18-10-8-15(9-11-18)29(38)32-27-19-5-2-1-4-16(19)14-24(27)42-31(41)17-12-22(35)26(23(36)13-17)28(37)25-20(30(39)40)6-3-7-21(25)34/h1-13,24,27,33-36H,14H2,(H,32,38)(H,39,40)/t24?,27-/m0/s1
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Article
n/an/a>1.00E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of cAMP-dependent protein kinase (PKA)


Bioorg Med Chem Lett 6: 973-978 (1996)


Article DOI: 10.1016/0960-894X(96)00151-5
BindingDB Entry DOI: 10.7270/Q23B603M
More data for this
Ligand-Target Pair
Protein kinase C, epsilon


(Homo sapiens (Human))
BDBM50289210
PNG
(4-(2-Carboxy-6-hydroxy-benzoyl)-3,5-dihydroxy-benz...)
Show SMILES OC(=O)c1cccc(O)c1C(=O)c1c(O)cc(cc1O)C(=O)OC1Cc2ccccc2[C@@H]1NC(=O)c1ccc(O)cc1
Show InChI InChI=1S/C31H23NO10/c33-18-10-8-15(9-11-18)29(38)32-27-19-5-2-1-4-16(19)14-24(27)42-31(41)17-12-22(35)26(23(36)13-17)28(37)25-20(30(39)40)6-3-7-21(25)34/h1-13,24,27,33-36H,14H2,(H,32,38)(H,39,40)/t24?,27-/m0/s1
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Article
n/an/a 2.50E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of protein kinase C epsilon


Bioorg Med Chem Lett 6: 973-978 (1996)


Article DOI: 10.1016/0960-894X(96)00151-5
BindingDB Entry DOI: 10.7270/Q23B603M
More data for this
Ligand-Target Pair
PKC alpha and beta-2


(Homo sapiens (Human))
BDBM50289210
PNG
(4-(2-Carboxy-6-hydroxy-benzoyl)-3,5-dihydroxy-benz...)
Show SMILES OC(=O)c1cccc(O)c1C(=O)c1c(O)cc(cc1O)C(=O)OC1Cc2ccccc2[C@@H]1NC(=O)c1ccc(O)cc1
Show InChI InChI=1S/C31H23NO10/c33-18-10-8-15(9-11-18)29(38)32-27-19-5-2-1-4-16(19)14-24(27)42-31(41)17-12-22(35)26(23(36)13-17)28(37)25-20(30(39)40)6-3-7-21(25)34/h1-13,24,27,33-36H,14H2,(H,32,38)(H,39,40)/t24?,27-/m0/s1
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n/an/a 3.70E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of protein kinase C beta 1


Bioorg Med Chem Lett 6: 973-978 (1996)


Article DOI: 10.1016/0960-894X(96)00151-5
BindingDB Entry DOI: 10.7270/Q23B603M
More data for this
Ligand-Target Pair
PKC alpha and beta-2


(Homo sapiens (Human))
BDBM50289210
PNG
(4-(2-Carboxy-6-hydroxy-benzoyl)-3,5-dihydroxy-benz...)
Show SMILES OC(=O)c1cccc(O)c1C(=O)c1c(O)cc(cc1O)C(=O)OC1Cc2ccccc2[C@@H]1NC(=O)c1ccc(O)cc1
Show InChI InChI=1S/C31H23NO10/c33-18-10-8-15(9-11-18)29(38)32-27-19-5-2-1-4-16(19)14-24(27)42-31(41)17-12-22(35)26(23(36)13-17)28(37)25-20(30(39)40)6-3-7-21(25)34/h1-13,24,27,33-36H,14H2,(H,32,38)(H,39,40)/t24?,27-/m0/s1
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Article
n/an/a 3.70E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of protein kinase C beta II


Bioorg Med Chem Lett 6: 973-978 (1996)


Article DOI: 10.1016/0960-894X(96)00151-5
BindingDB Entry DOI: 10.7270/Q23B603M
More data for this
Ligand-Target Pair