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6 similar compounds to monomer 50148586

Compile data set for download or QSAR
Wt: 488.6
BDBM50148581
Wt: 418.5
BDBM50148583
Wt: 376.4
BDBM50148584
Wt: 390.4
BDBM50148596
Wt: 374.4
BDBM50195744
Wt: 460.5
BDBM50287675

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50148581,50148583,50148584,50148596,50195744,50287675   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Fibonectin-binding protein C


(Mycobacterium tuberculosis)
BDBM50148581
PNG
(CHEMBL119236 | Tetradecyl-phosphonic acid ethyl es...)
Show SMILES CCCCCCCCCCCCCCP(=O)(OCC)OCc1cccc(Oc2ccccc2)c1
Show InChI InChI=1S/C29H45O4P/c1-3-5-6-7-8-9-10-11-12-13-14-18-24-34(30,31-4-2)32-26-27-20-19-23-29(25-27)33-28-21-16-15-17-22-28/h15-17,19-23,25H,3-14,18,24,26H2,1-2H3
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PC cid
PC sid
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Article
PubMed
n/an/a 8.62E+5n/an/an/an/an/an/a



University of Ljubljana

Curated by ChEMBL


Assay Description
In vitro concentration required to inhibit antigen 85C mycolyltransferase activity in Mycobaterium tuberculosis


Bioorg Med Chem Lett 14: 3559-62 (2004)


Article DOI: 10.1016/j.bmcl.2004.04.052
BindingDB Entry DOI: 10.7270/Q2C828RQ
More data for this
Ligand-Target Pair
Fibonectin-binding protein C


(Mycobacterium tuberculosis)
BDBM50148583
PNG
(CHEMBL325149 | Nonyl-phosphonic acid ethyl ester 3...)
Show SMILES CCCCCCCCCP(=O)(OCC)OCc1cccc(Oc2ccccc2)c1
Show InChI InChI=1S/C24H35O4P/c1-3-5-6-7-8-9-13-19-29(25,26-4-2)27-21-22-15-14-18-24(20-22)28-23-16-11-10-12-17-23/h10-12,14-18,20H,3-9,13,19,21H2,1-2H3
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Article
PubMed
n/an/a 1.48E+4n/an/an/an/an/an/a



University of Ljubljana

Curated by ChEMBL


Assay Description
In vitro concentration required to inhibit antigen 85C mycolyltransferase activity in Mycobaterium tuberculosis


Bioorg Med Chem Lett 14: 3559-62 (2004)


Article DOI: 10.1016/j.bmcl.2004.04.052
BindingDB Entry DOI: 10.7270/Q2C828RQ
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50287675
PNG
(CHEMBL58643 | Tetradecyl-phosphonic acid mono-(3-p...)
Show SMILES CCCCCCCCCCCCCCP(O)(=O)OCc1cccc(Oc2ccccc2)c1
Show InChI InChI=1S/C27H41O4P/c1-2-3-4-5-6-7-8-9-10-11-12-16-22-32(28,29)30-24-25-18-17-21-27(23-25)31-26-19-14-13-15-20-26/h13-15,17-21,23H,2-12,16,22,24H2,1H3,(H,28,29)
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antibodypedia
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Article
n/an/a 6.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested for inhibition of [3H]-cholesteryl linoleate(CE) transfer from donor HDL to acceptor LDL driven by recombinant human Cholesteryl ester transfe...


Bioorg Med Chem Lett 6: 1951-1954 (1996)


Article DOI: 10.1016/0960-894X(96)00350-2
BindingDB Entry DOI: 10.7270/Q2Z89CCZ
More data for this
Ligand-Target Pair
Fibonectin-binding protein C


(Mycobacterium tuberculosis)
BDBM50148596
PNG
(CHEMBL278017 | Heptyl-phosphonic acid ethyl ester ...)
Show SMILES CCCCCCCP(=O)(OCC)OCc1cccc(Oc2ccccc2)c1
Show InChI InChI=1S/C22H31O4P/c1-3-5-6-7-11-17-27(23,24-4-2)25-19-20-13-12-16-22(18-20)26-21-14-9-8-10-15-21/h8-10,12-16,18H,3-7,11,17,19H2,1-2H3
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PubMed
n/an/a 2.10E+4n/an/an/an/an/an/a



University of Ljubljana

Curated by ChEMBL


Assay Description
In vitro concentration required to inhibit antigen 85C mycolyltransferase activity in Mycobaterium tuberculosis


Bioorg Med Chem Lett 14: 3559-62 (2004)


Article DOI: 10.1016/j.bmcl.2004.04.052
BindingDB Entry DOI: 10.7270/Q2C828RQ
More data for this
Ligand-Target Pair
Fibonectin-binding protein C


(Mycobacterium tuberculosis)
BDBM50195744
PNG
(CHEMBL227845 | ethyl 3,4,5-trimethoxybenzyl hexylp...)
Show SMILES CCCCCCP(=O)(OCC)OCc1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C18H31O6P/c1-6-8-9-10-11-25(19,23-7-2)24-14-15-12-16(20-3)18(22-5)17(13-15)21-4/h12-13H,6-11,14H2,1-5H3
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PC sid
UniChem

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Article
PubMed
n/an/a 1.02E+5n/an/an/an/an/an/a



University of Ljubljana

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis recombinant antigen 85C mycolyltransferase


Eur J Med Chem 42: 54-63 (2007)


Article DOI: 10.1016/j.ejmech.2006.08.007
BindingDB Entry DOI: 10.7270/Q2F18ZB3
More data for this
Ligand-Target Pair
Fibonectin-binding protein C


(Mycobacterium tuberculosis)
BDBM50148584
PNG
(CHEMBL118790 | Hexyl-phosphonic acid ethyl ester 3...)
Show SMILES CCCCCCP(=O)(OCC)OCc1cccc(Oc2ccccc2)c1
Show InChI InChI=1S/C21H29O4P/c1-3-5-6-10-16-26(22,23-4-2)24-18-19-12-11-15-21(17-19)25-20-13-8-7-9-14-20/h7-9,11-15,17H,3-6,10,16,18H2,1-2H3
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Article
PubMed
n/an/a 4.26E+4n/an/an/an/an/an/a



University of Ljubljana

Curated by ChEMBL


Assay Description
In vitro concentration required to inhibit antigen 85C mycolyltransferase activity in Mycobaterium tuberculosis


Bioorg Med Chem Lett 14: 3559-62 (2004)


Article DOI: 10.1016/j.bmcl.2004.04.052
BindingDB Entry DOI: 10.7270/Q2C828RQ
More data for this
Ligand-Target Pair