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6 similar compounds to monomer 32212

Compile data set for download or QSAR
Wt: 231.2
BDBM4091
Wt: 233.2
BDBM6953
Wt: 133.1
BDBM21978
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Wt: 149.1
BDBM50028548
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Wt: 183.2
BDBM50127697
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Wt: 147.1
BDBM50400288
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 4091,6953,21978,50028548,50127697,50400288   
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
Catechol-O-methyltransferase


(Rattus norvegicus (Rat))
BDBM50028548
PNG
(1H-indole-5,6-diol | 5,6-dihydroxyindole | CHEMBL9...)
Show SMILES Oc1cc2cc[nH]c2cc1O
Show InChI InChI=1S/C8H7NO2/c10-7-3-5-1-2-9-6(5)4-8(7)11/h1-4,9-11H
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3.46E+6n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Kinetic constants for the inactivation of Catechol O-methyltransferase by the compound


J Med Chem 25: 263-71 (1982)


Article DOI: 10.1021/jm00345a013
BindingDB Entry DOI: 10.7270/Q2G15ZV0
More data for this
Ligand-Target Pair
cAMP-Dependent Protein Kinase (PKA)


(Bos taurus (bovine))
BDBM4091
PNG
(9H-carbazole-2,3,6,7-tetrol | Carbazole deriv. 9a)
Show SMILES Oc1cc2[nH]c3cc(O)c(O)cc3c2cc1O
Show InChI InChI=1S/C12H9NO4/c14-9-1-5-6-2-10(15)12(17)4-8(6)13-7(5)3-11(9)16/h1-4,13-17H
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n/an/a 5.80E+4n/an/an/an/an/an/a



Pfizer



Assay Description
IC50 is the inhibitor concentration, which inhibits 50% of PKA activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] label...


J Med Chem 37: 2224-31 (1994)


Article DOI: 10.1021/jm00040a015
BindingDB Entry DOI: 10.7270/Q27M0648
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6953
PNG
(11-azatetracyclo[8.7.0.0^{2,7}.0^{12,17}]heptadeca...)
Show SMILES Oc1ccc2ccc3[nH]c4ccccc4c3c2c1
Show InChI InChI=1S/C16H11NO/c18-11-7-5-10-6-8-15-16(13(10)9-11)12-3-1-2-4-14(12)17-15/h1-9,17-18H
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n/an/a 1.74E+4n/an/an/an/a7.622



DuPont Pharmaceuticals Company



Assay Description
The enzyme was assayed with substrate GST-Rb in the presence of 50 mM ATP/[gamma-32P] ATP, and capturing the 32-P labeled reaction products on GSH-Se...


Bioorg Med Chem Lett 11: 2209-11 (2001)


Article DOI: 10.1016/s0960-894x(01)00416-4
BindingDB Entry DOI: 10.7270/Q2P55KPF
More data for this
Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase (IMPDH)


(Homo sapiens (Human))
BDBM50127697
PNG
(4-hydroxycarbazole | 9H-Carbazol-4-ol | CHEMBL4672...)
Show SMILES Oc1cccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C12H9NO/c14-11-7-3-6-10-12(11)8-4-1-2-5-9(8)13-10/h1-7,13-14H
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n/an/a 5.40E+4n/an/an/an/an/an/a



Roche Discovery Welwyn

Curated by ChEMBL


Assay Description
Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase


Bioorg Med Chem Lett 13: 1691-4 (2003)


Article DOI: 10.1016/s0960-894x(03)00237-3
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50127697
PNG
(4-hydroxycarbazole | 9H-Carbazol-4-ol | CHEMBL4672...)
Show SMILES Oc1cccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C12H9NO/c14-11-7-3-6-10-12(11)8-4-1-2-5-9(8)13-10/h1-7,13-14H
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n/an/a 4.00E+5n/an/an/an/an/an/a



Institute for Cancer Research

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IDO expressed in Escherichia coli BL21 AI


J Med Chem 53: 1172-89 (2010)


Article DOI: 10.1021/jm9014718
BindingDB Entry DOI: 10.7270/Q2BC40G9
More data for this
Ligand-Target Pair
Pantothenate synthetase


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50400288
PNG
(CHEMBL280311)
Show SMILES COc1ccc2[nH]ccc2c1
Show InChI InChI=1S/C9H9NO/c1-11-8-2-3-9-7(6-8)4-5-10-9/h2-6,10H,1H3
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n/an/an/a 1.10E+6n/an/an/an/an/a



University of Ljubljana

Curated by ChEMBL


Assay Description
Binding affinity to Mycobacterium tuberculosis Pantothenate synthetase ATP-binding site by ITC method


J Med Chem 54: 915-29 (2011)


Article DOI: 10.1021/jm101121s
BindingDB Entry DOI: 10.7270/Q2NS0W23
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM4091
PNG
(9H-carbazole-2,3,6,7-tetrol | Carbazole deriv. 9a)
Show SMILES Oc1cc2[nH]c3cc(O)c(O)cc3c2cc1O
Show InChI InChI=1S/C12H9NO4/c14-9-1-5-6-2-10(15)12(17)4-8(6)13-7(5)3-11(9)16/h1-4,13-17H
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n/an/a 1.50E+3n/an/an/an/an/an/a



Pfizer



Assay Description
IC50 is the inhibitor concentration, which inhibits 50% of pp60c-src activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] ...


J Med Chem 37: 2224-31 (1994)


Article DOI: 10.1021/jm00040a015
BindingDB Entry DOI: 10.7270/Q27M0648
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM21978
PNG
(1H-indol-4-ol | 4-hydroxyindole, 18)
Show SMILES Oc1cccc2[nH]ccc12
Show InChI InChI=1S/C8H7NO/c10-8-3-1-2-7-6(8)4-5-9-7/h1-5,9-10H
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n/an/an/an/an/an/an/a6.537



University of British Columbia



Assay Description
The ability of the compounds prepared in this study to inhibit purified recombinant human IDO was evaluated with a steady state spectrophotometric as...


J Med Chem 51: 2634-7 (2008)


Article DOI: 10.1021/jm800143h
BindingDB Entry DOI: 10.7270/Q2MK6B65
More data for this
Ligand-Target Pair