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6 similar compounds to monomer 50293375

Compile data set for download or QSAR
Wt: 425.5
BDBM50293371
Wt: 425.5
BDBM50293372
Wt: 497.5
BDBM50293373
Wt: 497.5
BDBM50293374
Wt: 383.4
BDBM50293381
Wt: 441.5
BDBM50293408

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 9 hits for monomerid = 50293371,50293372,50293373,50293374,50293381,50293408   
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
Coagulation factor VII/tissue factor


(Homo sapiens (Human))
BDBM50293371
PNG
((R)-2-(3-acetamido-4-oxo-3,4-dihydrobenzo[b][1,4]t...)
Show SMILES CC(=O)N[C@H]1CSc2ccccc2N(CC(=O)NCc2ccc(cc2)C(N)=N)C1=O
Show InChI InChI=1S/C21H23N5O3S/c1-13(27)25-16-12-30-18-5-3-2-4-17(18)26(21(16)29)11-19(28)24-10-14-6-8-15(9-7-14)20(22)23/h2-9,16H,10-12H2,1H3,(H3,22,23)(H,24,28)(H,25,27)/t16-/m0/s1
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n/an/a 3.73E+4n/an/an/an/an/an/a



Universit£ Montpellier 1

Curated by ChEMBL


Assay Description
Inhibition of human tissue factor/factor 7a


Bioorg Med Chem Lett 19: 1386-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.039
BindingDB Entry DOI: 10.7270/Q2G73DRB
More data for this
Ligand-Target Pair
Coagulation factor VII/tissue factor


(Homo sapiens (Human))
BDBM50293372
PNG
((S)-2-(3-acetamido-4-oxo-3,4-dihydrobenzo[b][1,4]t...)
Show SMILES CC(=O)N[C@@H]1CSc2ccccc2N(CC(=O)NCc2ccc(cc2)C(N)=N)C1=O
Show InChI InChI=1S/C21H23N5O3S/c1-13(27)25-16-12-30-18-5-3-2-4-17(18)26(21(16)29)11-19(28)24-10-14-6-8-15(9-7-14)20(22)23/h2-9,16H,10-12H2,1H3,(H3,22,23)(H,24,28)(H,25,27)/t16-/m1/s1
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n/an/a 9.00E+4n/an/an/an/an/an/a



Universit£ Montpellier 1

Curated by ChEMBL


Assay Description
Inhibition of human tissue factor/factor 7a


Bioorg Med Chem Lett 19: 1386-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.039
BindingDB Entry DOI: 10.7270/Q2G73DRB
More data for this
Ligand-Target Pair
Coagulation factor VII/tissue factor


(Homo sapiens (Human))
BDBM50293373
PNG
((R)-4-(5-(3-(4-carbamimidoylbenzylamino)-3-oxoprop...)
Show SMILES NC(=N)c1ccc(CNC(=O)CCN2c3ccccc3SC[C@H](NC(=O)CCC(O)=O)C2=O)cc1
Show InChI InChI=1S/C24H27N5O5S/c25-23(26)16-7-5-15(6-8-16)13-27-20(30)11-12-29-18-3-1-2-4-19(18)35-14-17(24(29)34)28-21(31)9-10-22(32)33/h1-8,17H,9-14H2,(H3,25,26)(H,27,30)(H,28,31)(H,32,33)/t17-/m0/s1
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n/an/a 1.66E+5n/an/an/an/an/an/a



Universit£ Montpellier 1

Curated by ChEMBL


Assay Description
Inhibition of human tissue factor/factor 7a


Bioorg Med Chem Lett 19: 1386-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.039
BindingDB Entry DOI: 10.7270/Q2G73DRB
More data for this
Ligand-Target Pair
Coagulation factor VII/tissue factor


(Homo sapiens (Human))
BDBM50293374
PNG
((S)-4-(5-(3-(4-carbamimidoylbenzylamino)-3-oxoprop...)
Show SMILES NC(=N)c1ccc(CNC(=O)CCN2c3ccccc3SC[C@@H](NC(=O)CCC(O)=O)C2=O)cc1
Show InChI InChI=1S/C24H27N5O5S/c25-23(26)16-7-5-15(6-8-16)13-27-20(30)11-12-29-18-3-1-2-4-19(18)35-14-17(24(29)34)28-21(31)9-10-22(32)33/h1-8,17H,9-14H2,(H3,25,26)(H,27,30)(H,28,31)(H,32,33)/t17-/m1/s1
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n/an/a 6.10E+4n/an/an/an/an/an/a



Universit£ Montpellier 1

Curated by ChEMBL


Assay Description
Inhibition of human tissue factor/factor 7a


Bioorg Med Chem Lett 19: 1386-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.039
BindingDB Entry DOI: 10.7270/Q2G73DRB
More data for this
Ligand-Target Pair
Coagulation factor VII/tissue factor


(Homo sapiens (Human))
BDBM50293408
PNG
((S)-2-(5-(2-(4-carbamimidoylbenzylamino)-2-oxoethy...)
Show SMILES NC(=N)c1ccc(CNC(=O)CN2c3ccccc3SC[C@@H](NCC(O)=O)C2=O)cc1
Show InChI InChI=1S/C21H23N5O4S/c22-20(23)14-7-5-13(6-8-14)9-25-18(27)11-26-16-3-1-2-4-17(16)31-12-15(21(26)30)24-10-19(28)29/h1-8,15,24H,9-12H2,(H3,22,23)(H,25,27)(H,28,29)/t15-/m1/s1
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n/an/a 1.59E+4n/an/an/an/an/an/a



Universit£ Montpellier 1

Curated by ChEMBL


Assay Description
Inhibition of human tissue factor/factor 7a


Bioorg Med Chem Lett 19: 1386-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.039
BindingDB Entry DOI: 10.7270/Q2G73DRB
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50293371
PNG
((R)-2-(3-acetamido-4-oxo-3,4-dihydrobenzo[b][1,4]t...)
Show SMILES CC(=O)N[C@H]1CSc2ccccc2N(CC(=O)NCc2ccc(cc2)C(N)=N)C1=O
Show InChI InChI=1S/C21H23N5O3S/c1-13(27)25-16-12-30-18-5-3-2-4-17(18)26(21(16)29)11-19(28)24-10-14-6-8-15(9-7-14)20(22)23/h2-9,16H,10-12H2,1H3,(H3,22,23)(H,24,28)(H,25,27)/t16-/m0/s1
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n/an/a 1.00E+5n/an/an/an/an/an/a



Universit£ Montpellier 1

Curated by ChEMBL


Assay Description
Inhibition of human factor 2a by spectrophotometry


Bioorg Med Chem Lett 19: 1386-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.039
BindingDB Entry DOI: 10.7270/Q2G73DRB
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50293373
PNG
((R)-4-(5-(3-(4-carbamimidoylbenzylamino)-3-oxoprop...)
Show SMILES NC(=N)c1ccc(CNC(=O)CCN2c3ccccc3SC[C@H](NC(=O)CCC(O)=O)C2=O)cc1
Show InChI InChI=1S/C24H27N5O5S/c25-23(26)16-7-5-15(6-8-16)13-27-20(30)11-12-29-18-3-1-2-4-19(18)35-14-17(24(29)34)28-21(31)9-10-22(32)33/h1-8,17H,9-14H2,(H3,25,26)(H,27,30)(H,28,31)(H,32,33)/t17-/m0/s1
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n/an/a>3.30E+4n/an/an/an/an/an/a



Universit£ Montpellier 1

Curated by ChEMBL


Assay Description
Inhibition of human factor 2a by spectrophotometry


Bioorg Med Chem Lett 19: 1386-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.039
BindingDB Entry DOI: 10.7270/Q2G73DRB
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50293381
PNG
((R)-2-(3-amino-4-oxo-3,4-dihydrobenzo[b][1,4]thiaz...)
Show SMILES N[C@H]1CSc2ccccc2N(CC(=O)NCc2ccc(cc2)C(N)=N)C1=O
Show InChI InChI=1S/C19H21N5O2S/c20-14-11-27-16-4-2-1-3-15(16)24(19(14)26)10-17(25)23-9-12-5-7-13(8-6-12)18(21)22/h1-8,14H,9-11,20H2,(H3,21,22)(H,23,25)/t14-/m0/s1
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n/an/a 8.70E+4n/an/an/an/an/an/a



Universit£ Montpellier 1

Curated by ChEMBL


Assay Description
Inhibition of human factor 2a by spectrophotometry


Bioorg Med Chem Lett 19: 1386-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.039
BindingDB Entry DOI: 10.7270/Q2G73DRB
More data for this
Ligand-Target Pair
Coagulation factor VII/tissue factor


(Homo sapiens (Human))
BDBM50293381
PNG
((R)-2-(3-amino-4-oxo-3,4-dihydrobenzo[b][1,4]thiaz...)
Show SMILES N[C@H]1CSc2ccccc2N(CC(=O)NCc2ccc(cc2)C(N)=N)C1=O
Show InChI InChI=1S/C19H21N5O2S/c20-14-11-27-16-4-2-1-3-15(16)24(19(14)26)10-17(25)23-9-12-5-7-13(8-6-12)18(21)22/h1-8,14H,9-11,20H2,(H3,21,22)(H,23,25)/t14-/m0/s1
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n/an/a 2.44E+4n/an/an/an/an/an/a



Universit£ Montpellier 1

Curated by ChEMBL


Assay Description
Inhibition of human tissue factor/factor 7a


Bioorg Med Chem Lett 19: 1386-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.039
BindingDB Entry DOI: 10.7270/Q2G73DRB
More data for this
Ligand-Target Pair