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89 similar compounds to monomer 35743

Compile data set for download or QSAR
Wt: 544.0
BDBM35748
Wt: 544.0
BDBM35749
Wt: 544.0
BDBM35750
Wt: 561.0
BDBM35751
Wt: 561.0
BDBM35752
Wt: 561.0
BDBM35753
Wt: 621.9
BDBM35754
Wt: 561.0
BDBM35755
Wt: 571.0
BDBM35756
Wt: 614.1
BDBM35757
Wt: 526.6
BDBM35758
Wt: 587.5
BDBM35759
Wt: 554.1
BDBM35760
Wt: 555.0
BDBM35761
Wt: 555.0
BDBM35762
Displayed 1 to 15 (of 89 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 15 hits for monomerid = 35748,35749,35750,35751,35752,35753,35754,35755,35756,35757,35758,35759,35760,35761,35762   
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 X


(Homo sapiens (Human))
BDBM35748
PNG
(cis-1,2-diaminocyclohexane derivative, 8e)
Show SMILES CN(C)C(=O)[C@H]1CC[C@H](NC(=O)c2nc3ccc(Cl)cc3[nH]2)[C@@H](C1)NC(=O)c1nc2CCN(C)Cc2s1
Show InChI InChI=1/C25H30ClN7O3S/c1-32(2)25(36)13-4-6-16(29-22(34)21-27-15-7-5-14(26)11-19(15)28-21)18(10-13)30-23(35)24-31-17-8-9-33(3)12-20(17)37-24/h5,7,11,13,16,18H,4,6,8-10,12H2,1-3H3,(H,27,28)(H,29,34)(H,30,35)/t13-,16-,18+/s2
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n/an/a 6.5n/an/an/an/a7.423



Daiichi Sankyo Co, Ltd



Assay Description
The in vitro anti-fXa activity was measured by using a chromogenic substrate S-2222 and human fXa. Aqueous DMSO or test compounds in aqueous DMSO and...


Bioorg Med Chem 17: 8206-20 (2009)


Article DOI: 10.1016/j.bmc.2009.10.023
BindingDB Entry DOI: 10.7270/Q2H130CP
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM35756
PNG
(cis-1,2-diaminocyclohexane derivative, 8m)
Show SMILES CN(C)C(=O)[C@H]1CC[C@H](NC(=O)c2[nH]c3ccc(Cl)cc3c2C=O)[C@@H](C1)NC(=O)c1nc2CCN(C)Cc2s1
Show InChI InChI=1/C27H31ClN6O4S/c1-33(2)27(38)14-4-6-19(30-24(36)23-17(13-35)16-11-15(28)5-7-18(16)29-23)21(10-14)31-25(37)26-32-20-8-9-34(3)12-22(20)39-26/h5,7,11,13-14,19,21,29H,4,6,8-10,12H2,1-3H3,(H,30,36)(H,31,37)/t14-,19-,21+/s2
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n/an/a 2.10n/an/an/an/a7.423



Daiichi Sankyo Co, Ltd



Assay Description
The in vitro anti-fXa activity was measured by using a chromogenic substrate S-2222 and human fXa. Aqueous DMSO or test compounds in aqueous DMSO and...


Bioorg Med Chem 17: 8206-20 (2009)


Article DOI: 10.1016/j.bmc.2009.10.023
BindingDB Entry DOI: 10.7270/Q2H130CP
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM35750
PNG
(cis-1,2-diaminocyclohexane derivative, 8g)
Show SMILES CN(C)C(=O)[C@H]1CC[C@H](NC(=O)c2cc3nc(Cl)ccc3[nH]2)[C@@H](C1)NC(=O)c1nc2CCN(C)Cc2s1
Show InChI InChI=1/C25H30ClN7O3S/c1-32(2)25(36)13-4-5-15(29-22(34)19-11-18-14(27-19)6-7-21(26)28-18)17(10-13)30-23(35)24-31-16-8-9-33(3)12-20(16)37-24/h6-7,11,13,15,17,27H,4-5,8-10,12H2,1-3H3,(H,29,34)(H,30,35)/t13-,15-,17+/s2
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n/an/a 55n/an/an/an/a7.423



Daiichi Sankyo Co, Ltd



Assay Description
The in vitro anti-fXa activity was measured by using a chromogenic substrate S-2222 and human fXa. Aqueous DMSO or test compounds in aqueous DMSO and...


Bioorg Med Chem 17: 8206-20 (2009)


Article DOI: 10.1016/j.bmc.2009.10.023
BindingDB Entry DOI: 10.7270/Q2H130CP
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM35751
PNG
(cis-1,2-diaminocyclohexane derivative, 8h)
Show SMILES CN(C)C(=O)[C@H]1CC[C@H](NC(=O)c2cc3c(F)c(Cl)ccc3[nH]2)[C@@H](C1)NC(=O)c1nc2CCN(C)Cc2s1
Show InChI InChI=1/C26H30ClFN6O3S/c1-33(2)26(37)13-4-6-17(30-23(35)20-11-14-16(29-20)7-5-15(27)22(14)28)19(10-13)31-24(36)25-32-18-8-9-34(3)12-21(18)38-25/h5,7,11,13,17,19,29H,4,6,8-10,12H2,1-3H3,(H,30,35)(H,31,36)/t13-,17-,19+/s2
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n/an/a 1.40n/an/an/an/a7.423



Daiichi Sankyo Co, Ltd



Assay Description
The in vitro anti-fXa activity was measured by using a chromogenic substrate S-2222 and human fXa. Aqueous DMSO or test compounds in aqueous DMSO and...


Bioorg Med Chem 17: 8206-20 (2009)


Article DOI: 10.1016/j.bmc.2009.10.023
BindingDB Entry DOI: 10.7270/Q2H130CP
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM35752
PNG
(cis-1,2-diaminocyclohexane derivative, 8i)
Show SMILES CN(C)C(=O)[C@H]1CC[C@H](NC(=O)c2cc3cc(Cl)cc(F)c3[nH]2)[C@@H](C1)NC(=O)c1nc2CCN(C)Cc2s1
Show InChI InChI=1/C26H30ClFN6O3S/c1-33(2)26(37)13-4-5-17(30-23(35)20-10-14-8-15(27)11-16(28)22(14)29-20)19(9-13)31-24(36)25-32-18-6-7-34(3)12-21(18)38-25/h8,10-11,13,17,19,29H,4-7,9,12H2,1-3H3,(H,30,35)(H,31,36)/t13-,17-,19+/s2
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n/an/a 49n/an/an/an/a7.423



Daiichi Sankyo Co, Ltd



Assay Description
The in vitro anti-fXa activity was measured by using a chromogenic substrate S-2222 and human fXa. Aqueous DMSO or test compounds in aqueous DMSO and...


Bioorg Med Chem 17: 8206-20 (2009)


Article DOI: 10.1016/j.bmc.2009.10.023
BindingDB Entry DOI: 10.7270/Q2H130CP
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM35753
PNG
(cis-1,2-diaminocyclohexane derivative, 8j)
Show SMILES CN(C)C(=O)[C@H]1CC[C@H](NC(=O)c2[nH]c3ccc(Cl)cc3c2F)[C@@H](C1)NC(=O)c1nc2CCN(C)Cc2s1
Show InChI InChI=1/C26H30ClFN6O3S/c1-33(2)26(37)13-4-6-17(30-23(35)22-21(28)15-11-14(27)5-7-16(15)29-22)19(10-13)31-24(36)25-32-18-8-9-34(3)12-20(18)38-25/h5,7,11,13,17,19,29H,4,6,8-10,12H2,1-3H3,(H,30,35)(H,31,36)/t13-,17-,19+/s2
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n/an/a 3.5n/an/an/an/a7.423



Daiichi Sankyo Co, Ltd



Assay Description
The in vitro anti-fXa activity was measured by using a chromogenic substrate S-2222 and human fXa. Aqueous DMSO or test compounds in aqueous DMSO and...


Bioorg Med Chem 17: 8206-20 (2009)


Article DOI: 10.1016/j.bmc.2009.10.023
BindingDB Entry DOI: 10.7270/Q2H130CP
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM35757
PNG
(cis-1,2-diaminocyclohexane derivative, 8n)
Show SMILES CN(C)C(=O)[C@H]1CC[C@H](NC(=O)c2[nH]c3ccc(Cl)cc3c2C(=O)N(C)C)[C@@H](C1)NC(=O)c1nc2CCN(C)Cc2s1
Show InChI InChI=1/C29H36ClN7O4S/c1-35(2)28(40)15-6-8-19(21(12-15)33-26(39)27-34-20-10-11-37(5)14-22(20)42-27)32-25(38)24-23(29(41)36(3)4)17-13-16(30)7-9-18(17)31-24/h7,9,13,15,19,21,31H,6,8,10-12,14H2,1-5H3,(H,32,38)(H,33,39)/t15-,19-,21+/s2
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n/an/a 37n/an/an/an/a7.423



Daiichi Sankyo Co, Ltd



Assay Description
The in vitro anti-fXa activity was measured by using a chromogenic substrate S-2222 and human fXa. Aqueous DMSO or test compounds in aqueous DMSO and...


Bioorg Med Chem 17: 8206-20 (2009)


Article DOI: 10.1016/j.bmc.2009.10.023
BindingDB Entry DOI: 10.7270/Q2H130CP
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM35758
PNG
(cis-1,2-diaminocyclohexane derivative, 8o)
Show SMILES CN(C)C(=O)[C@H]1CC[C@H](NC(=O)c2cc3cc(F)ccc3[nH]2)[C@@H](C1)NC(=O)c1nc2CCN(C)Cc2s1
Show InChI InChI=1/C26H31FN6O3S/c1-32(2)26(36)14-4-6-18(29-23(34)21-12-15-10-16(27)5-7-17(15)28-21)20(11-14)30-24(35)25-31-19-8-9-33(3)13-22(19)37-25/h5,7,10,12,14,18,20,28H,4,6,8-9,11,13H2,1-3H3,(H,29,34)(H,30,35)/t14-,18-,20+/s2
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n/an/a 15n/an/an/an/a7.423



Daiichi Sankyo Co, Ltd



Assay Description
The in vitro anti-fXa activity was measured by using a chromogenic substrate S-2222 and human fXa. Aqueous DMSO or test compounds in aqueous DMSO and...


Bioorg Med Chem 17: 8206-20 (2009)


Article DOI: 10.1016/j.bmc.2009.10.023
BindingDB Entry DOI: 10.7270/Q2H130CP
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM35759
PNG
(cis-1,2-diaminocyclohexane derivative, 8p)
Show SMILES CN(C)C(=O)[C@H]1CC[C@H](NC(=O)c2cc3cc(Br)ccc3[nH]2)[C@@H](C1)NC(=O)c1nc2CCN(C)Cc2s1
Show InChI InChI=1/C26H31BrN6O3S/c1-32(2)26(36)14-4-6-18(29-23(34)21-12-15-10-16(27)5-7-17(15)28-21)20(11-14)30-24(35)25-31-19-8-9-33(3)13-22(19)37-25/h5,7,10,12,14,18,20,28H,4,6,8-9,11,13H2,1-3H3,(H,29,34)(H,30,35)/t14-,18-,20+/s2
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n/an/a 3.20n/an/an/an/a7.423



Daiichi Sankyo Co, Ltd



Assay Description
The in vitro anti-fXa activity was measured by using a chromogenic substrate S-2222 and human fXa. Aqueous DMSO or test compounds in aqueous DMSO and...


Bioorg Med Chem 17: 8206-20 (2009)


Article DOI: 10.1016/j.bmc.2009.10.023
BindingDB Entry DOI: 10.7270/Q2H130CP
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM35760
PNG
(cis-1,2-diaminocyclohexane derivative, 5a)
Show SMILES CN(C)C(=O)[C@H]1CC[C@H](NC(=O)c2ccc3cc(Cl)ccc3c2)[C@@H](C1)NC(=O)c1nc2CCN(C)Cc2s1
Show InChI InChI=1/C28H32ClN5O3S/c1-33(2)28(37)19-7-9-21(30-25(35)18-5-4-17-13-20(29)8-6-16(17)12-18)23(14-19)31-26(36)27-32-22-10-11-34(3)15-24(22)38-27/h4-6,8,12-13,19,21,23H,7,9-11,14-15H2,1-3H3,(H,30,35)(H,31,36)/t19-,21-,23+/s2
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n/an/a 5.70n/an/an/an/a7.423



Daiichi Sankyo Co, Ltd



Assay Description
The in vitro anti-fXa activity was measured by using a chromogenic substrate S-2222 and human fXa. Aqueous DMSO or test compounds in aqueous DMSO and...


Bioorg Med Chem 17: 8221-33 (2009)


Article DOI: 10.1016/j.bmc.2009.10.024
BindingDB Entry DOI: 10.7270/Q2CC0Z1V
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM35761
PNG
(cis-1,2-diaminocyclohexane derivative, 5b)
Show SMILES CN(C)C(=O)[C@H]1CC[C@H](NC(=O)c2ccc3cc(Cl)ccc3n2)[C@@H](C1)NC(=O)c1nc2CCN(C)Cc2s1
Show InChI InChI=1/C27H31ClN6O3S/c1-33(2)27(37)16-5-7-19(30-24(35)21-8-4-15-12-17(28)6-9-18(15)29-21)22(13-16)31-25(36)26-32-20-10-11-34(3)14-23(20)38-26/h4,6,8-9,12,16,19,22H,5,7,10-11,13-14H2,1-3H3,(H,30,35)(H,31,36)/t16-,19-,22+/s2
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n/an/a 4.00E+3n/an/an/an/a7.423



Daiichi Sankyo Co, Ltd



Assay Description
The in vitro anti-fXa activity was measured by using a chromogenic substrate S-2222 and human fXa. Aqueous DMSO or test compounds in aqueous DMSO and...


Bioorg Med Chem 17: 8221-33 (2009)


Article DOI: 10.1016/j.bmc.2009.10.024
BindingDB Entry DOI: 10.7270/Q2CC0Z1V
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM35762
PNG
(cis-1,2-diaminocyclohexane derivative, 5c)
Show SMILES CN(C)C(=O)[C@H]1CC[C@H](NC(=O)c2cc3ccc(Cl)cc3cn2)[C@@H](C1)NC(=O)c1nc2CCN(C)Cc2s1
Show InChI InChI=1/C27H31ClN6O3S/c1-33(2)27(37)16-5-7-19(30-24(35)22-11-15-4-6-18(28)10-17(15)13-29-22)21(12-16)31-25(36)26-32-20-8-9-34(3)14-23(20)38-26/h4,6,10-11,13,16,19,21H,5,7-9,12,14H2,1-3H3,(H,30,35)(H,31,36)/t16-,19-,21+/s2
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n/an/a 3n/an/an/an/a7.423



Daiichi Sankyo Co, Ltd



Assay Description
The in vitro anti-fXa activity was measured by using a chromogenic substrate S-2222 and human fXa. Aqueous DMSO or test compounds in aqueous DMSO and...


Bioorg Med Chem 17: 8221-33 (2009)


Article DOI: 10.1016/j.bmc.2009.10.024
BindingDB Entry DOI: 10.7270/Q2CC0Z1V
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM35754
PNG
(cis-1,2-diaminocyclohexane derivative, 8k)
Show SMILES CN(C)C(=O)[C@H]1CC[C@H](NC(=O)c2[nH]c3ccc(Cl)cc3c2Br)[C@@H](C1)NC(=O)c1nc2CCN(C)Cc2s1
Show InChI InChI=1/C26H30BrClN6O3S/c1-33(2)26(37)13-4-6-17(30-23(35)22-21(27)15-11-14(28)5-7-16(15)29-22)19(10-13)31-24(36)25-32-18-8-9-34(3)12-20(18)38-25/h5,7,11,13,17,19,29H,4,6,8-10,12H2,1-3H3,(H,30,35)(H,31,36)/t13-,17-,19+/s2
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n/an/a 4.80n/an/an/an/a7.423



Daiichi Sankyo Co, Ltd



Assay Description
The in vitro anti-fXa activity was measured by using a chromogenic substrate S-2222 and human fXa. Aqueous DMSO or test compounds in aqueous DMSO and...


Bioorg Med Chem 17: 8206-20 (2009)


Article DOI: 10.1016/j.bmc.2009.10.023
BindingDB Entry DOI: 10.7270/Q2H130CP
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM35755
PNG
(cis-1,2-diaminocyclohexane derivative, 8l)
Show SMILES CN(C)C(=O)[C@H]1CC[C@H](NC(=O)c2[nH]c3ccc(F)cc3c2Cl)[C@@H](C1)NC(=O)c1nc2CCN(C)Cc2s1
Show InChI InChI=1/C26H30ClFN6O3S/c1-33(2)26(37)13-4-6-17(30-23(35)22-21(27)15-11-14(28)5-7-16(15)29-22)19(10-13)31-24(36)25-32-18-8-9-34(3)12-20(18)38-25/h5,7,11,13,17,19,29H,4,6,8-10,12H2,1-3H3,(H,30,35)(H,31,36)/t13-,17-,19+/s2
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n/an/a 5.70n/an/an/an/a7.423



Daiichi Sankyo Co, Ltd



Assay Description
The in vitro anti-fXa activity was measured by using a chromogenic substrate S-2222 and human fXa. Aqueous DMSO or test compounds in aqueous DMSO and...


Bioorg Med Chem 17: 8206-20 (2009)


Article DOI: 10.1016/j.bmc.2009.10.023
BindingDB Entry DOI: 10.7270/Q2H130CP
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM35749
PNG
(cis-1,2-diaminocyclohexane derivative, 8f)
Show SMILES CN(C)C(=O)[C@H]1CC[C@H](NC(=O)c2cc3cc(Cl)ncc3[nH]2)[C@@H](C1)NC(=O)c1nc2CCN(C)Cc2s1
Show InChI InChI=1/C25H30ClN7O3S/c1-32(2)25(36)13-4-5-15(29-22(34)18-9-14-10-21(26)27-11-19(14)28-18)17(8-13)30-23(35)24-31-16-6-7-33(3)12-20(16)37-24/h9-11,13,15,17,28H,4-8,12H2,1-3H3,(H,29,34)(H,30,35)/t13-,15-,17+/s2
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n/an/a 69n/an/an/an/a7.423



Daiichi Sankyo Co, Ltd



Assay Description
The in vitro anti-fXa activity was measured by using a chromogenic substrate S-2222 and human fXa. Aqueous DMSO or test compounds in aqueous DMSO and...


Bioorg Med Chem 17: 8206-20 (2009)


Article DOI: 10.1016/j.bmc.2009.10.023
BindingDB Entry DOI: 10.7270/Q2H130CP
More data for this
Ligand-Target Pair