Found 46 hits Enz. Inhib. hit(s) with all data for entry = 50010343 Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537844
(CHEMBL4643136)Show SMILES CN(C)C(=O)[C@@H]1CC[C@@H](NC(=O)c2nc3CCN(C)Cc3s2)[C@H](C1)NC(=O)C(=O)Nc1ccc(Cl)cn1 |r| Show InChI InChI=1S/C24H30ClN7O4S/c1-31(2)24(36)13-4-6-15(27-22(35)23-29-16-8-9-32(3)12-18(16)37-23)17(10-13)28-20(33)21(34)30-19-7-5-14(25)11-26-19/h5,7,11,13,15,17H,4,6,8-10,12H2,1-3H3,(H,27,35)(H,28,33)(H,26,30,34)/t13-,15-,17+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537826
(CHEMBL4645930)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1ccc(Cl)cc1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C29H40ClN3O2S/c1-5-35-24(34)28(4)14-6-13-27(3)21(28)12-16-29-17-23(26(2,18-29)15-11-22(27)29)32-33-25(36)31-20-9-7-19(30)8-10-20/h7-10,21-22H,5-6,11-18H2,1-4H3,(H2,31,33,36)/b32-23+/t21-,22-,26-,27+,28+,29-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 153 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537827
(CHEMBL4635562)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1cccc(Cl)c1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C29H40ClN3O2S/c1-5-35-24(34)28(4)13-7-12-27(3)21(28)11-15-29-17-23(26(2,18-29)14-10-22(27)29)32-33-25(36)31-20-9-6-8-19(30)16-20/h6,8-9,16,21-22H,5,7,10-15,17-18H2,1-4H3,(H2,31,33,36)/b32-23+/t21-,22-,26-,27+,28+,29-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 196 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537828
(CHEMBL4635937)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1ccccc1Cl)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C29H40ClN3O2S/c1-5-35-24(34)28(4)14-8-13-27(3)21(28)12-16-29-17-23(26(2,18-29)15-11-22(27)29)32-33-25(36)31-20-10-7-6-9-19(20)30/h6-7,9-10,21-22H,5,8,11-18H2,1-4H3,(H2,31,33,36)/b32-23+/t21-,22-,26-,27+,28+,29-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 209 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50504374
(Isosteviol)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(CC3=O)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(O)=O |r| Show InChI InChI=1S/C20H30O3/c1-17-9-5-14-18(2)7-4-8-19(3,16(22)23)13(18)6-10-20(14,12-17)11-15(17)21/h13-14H,4-12H2,1-3H3,(H,22,23)/t13-,14-,17-,18+,19+,20-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
MCE
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 642 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50504398
(CHEMBL455441)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(CC3=O)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r| Show InChI InChI=1S/C22H34O3/c1-5-25-18(24)21(4)10-6-9-20(3)15(21)8-12-22-13-17(23)19(2,14-22)11-7-16(20)22/h15-16H,5-14H2,1-4H3/t15-,16-,19-,20+,21+,22-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 786 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537840
(CHEMBL4639910)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1cccc3ccccc13)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:1.3.2:6| Show InChI InChI=1S/C33H43N3O2S/c1-5-38-28(37)32(4)17-9-16-31(3)25(32)15-19-33-20-27(30(2,21-33)18-14-26(31)33)35-36-29(39)34-24-13-8-11-22-10-6-7-12-23(22)24/h6-8,10-13,25-26H,5,9,14-21H2,1-4H3,(H2,34,36,39)/b35-27+/t25-,26-,30-,31+,32+,33-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 955 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537823
(CHEMBL4643741)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/N)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C22H36N2O2/c1-5-26-18(25)21(4)10-6-9-20(3)15(21)8-12-22-13-17(24-23)19(2,14-22)11-7-16(20)22/h15-16H,5-14,23H2,1-4H3/b24-17+/t15-,16-,19-,20+,21+,22-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.82E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537811
(CHEMBL4639769)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C[C@H]3OCc1cn(nn1)-c1ccc(Br)cc1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C31H42BrN3O3/c1-5-37-27(36)30(4)14-6-13-29(3)24(30)12-16-31-17-26(28(2,20-31)15-11-25(29)31)38-19-22-18-35(34-33-22)23-9-7-21(32)8-10-23/h7-10,18,24-26H,5-6,11-17,19-20H2,1-4H3/t24-,25-,26+,28-,29+,30+,31-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.34E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537843
(CHEMBL4639304)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1cccc(C)c1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:1.3.2:6| Show InChI InChI=1S/C30H43N3O2S/c1-6-35-25(34)29(5)14-8-13-28(4)22(29)12-16-30-18-24(27(3,19-30)15-11-23(28)30)32-33-26(36)31-21-10-7-9-20(2)17-21/h7,9-10,17,22-23H,6,8,11-16,18-19H2,1-5H3,(H2,31,33,36)/b32-24+/t22-,23-,27-,28+,29+,30-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.76E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537842
(CHEMBL4648774)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1ccccc1C)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:1.3.2:6| Show InChI InChI=1S/C30H43N3O2S/c1-6-35-25(34)29(5)15-9-14-28(4)22(29)13-17-30-18-24(27(3,19-30)16-12-23(28)30)32-33-26(36)31-21-11-8-7-10-20(21)2/h7-8,10-11,22-23H,6,9,12-19H2,1-5H3,(H2,31,33,36)/b32-24+/t22-,23-,27-,28+,29+,30-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 4.15E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537822
(CHEMBL4632364)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C[C@H]3OCc1cn(nn1)-c1cccc3ccccc13)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C35H45N3O3/c1-5-40-31(39)34(4)17-9-16-33(3)28(34)15-19-35-20-30(32(2,23-35)18-14-29(33)35)41-22-25-21-38(37-36-25)27-13-8-11-24-10-6-7-12-26(24)27/h6-8,10-13,21,28-30H,5,9,14-20,22-23H2,1-4H3/t28-,29-,30+,32-,33+,34+,35-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 4.87E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537812
(CHEMBL4643987)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C[C@H]3OCc1cn(nn1)-c1ccc(C)cc1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C32H45N3O3/c1-6-37-28(36)31(5)15-7-14-30(4)25(31)13-17-32-18-27(29(3,21-32)16-12-26(30)32)38-20-23-19-35(34-33-23)24-10-8-22(2)9-11-24/h8-11,19,25-27H,6-7,12-18,20-21H2,1-5H3/t25-,26-,27+,29-,30+,31+,32-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 5.53E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537809
(CHEMBL4645925)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C[C@H]3OCc1cn(nn1)-c1cc(C)cc(C)c1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C33H47N3O3/c1-7-38-29(37)32(6)12-8-11-31(5)26(32)10-14-33-18-28(30(4,21-33)13-9-27(31)33)39-20-24-19-36(35-34-24)25-16-22(2)15-23(3)17-25/h15-17,19,26-28H,7-14,18,20-21H2,1-6H3/t26-,27-,28+,30-,31+,32+,33-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 6.34E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537834
(CHEMBL4641025)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1ccc(OC)cc1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:1.3.2:6| Show InChI InChI=1S/C30H43N3O3S/c1-6-36-25(34)29(4)15-7-14-28(3)22(29)13-17-30-18-24(27(2,19-30)16-12-23(28)30)32-33-26(37)31-20-8-10-21(35-5)11-9-20/h8-11,22-23H,6-7,12-19H2,1-5H3,(H2,31,33,37)/b32-24+/t22-,23-,27-,28+,29+,30-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 6.65E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537818
(CHEMBL4649869)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C[C@H]3OCc1cn(nn1)-c1ccc3OCOc3c1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C32H43N3O5/c1-5-37-28(36)31(4)12-6-11-30(3)25(31)10-14-32-16-27(29(2,19-32)13-9-26(30)32)38-18-21-17-35(34-33-21)22-7-8-23-24(15-22)40-20-39-23/h7-8,15,17,25-27H,5-6,9-14,16,18-20H2,1-4H3/t25-,26-,27+,29-,30+,31+,32-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 7.57E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537841
(CHEMBL4644481)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1cccc(Cl)c1Cl)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:1.3.2:6| Show InChI InChI=1S/C29H39Cl2N3O2S/c1-5-36-24(35)28(4)13-7-12-27(3)20(28)11-15-29-16-22(26(2,17-29)14-10-21(27)29)33-34-25(37)32-19-9-6-8-18(30)23(19)31/h6,8-9,20-21H,5,7,10-17H2,1-4H3,(H2,32,34,37)/b33-22+/t20-,21-,26-,27+,28+,29-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 7.73E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537838
(CHEMBL4641614)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1ccc(cc1)[N+]([O-])=O)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:1.3.2:6| Show InChI InChI=1S/C29H40N4O4S/c1-5-37-24(34)28(4)14-6-13-27(3)21(28)12-16-29-17-23(26(2,18-29)15-11-22(27)29)31-32-25(38)30-19-7-9-20(10-8-19)33(35)36/h7-10,21-22H,5-6,11-18H2,1-4H3,(H2,30,32,38)/b31-23+/t21-,22-,26-,27+,28+,29-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 8.46E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537833
(CHEMBL4642692)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1ccc(cc1)C(F)(F)F)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:1.3.2:6| Show InChI InChI=1S/C30H40F3N3O2S/c1-5-38-24(37)28(4)14-6-13-27(3)21(28)12-16-29-17-23(26(2,18-29)15-11-22(27)29)35-36-25(39)34-20-9-7-19(8-10-20)30(31,32)33/h7-10,21-22H,5-6,11-18H2,1-4H3,(H2,34,36,39)/b35-23+/t21-,22-,26-,27+,28+,29-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 8.66E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537810
(CHEMBL4649385)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C[C@H]3OCc1cn(nn1)-c1ccc(F)cc1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C31H42FN3O3/c1-5-37-27(36)30(4)14-6-13-29(3)24(30)12-16-31-17-26(28(2,20-31)15-11-25(29)31)38-19-22-18-35(34-33-22)23-9-7-21(32)8-10-23/h7-10,18,24-26H,5-6,11-17,19-20H2,1-4H3/t24-,25-,26+,28-,29+,30+,31-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 8.74E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537830
(CHEMBL4642689)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1ccc(Br)cc1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:1.3.2:6| Show InChI InChI=1S/C29H40BrN3O2S/c1-5-35-24(34)28(4)14-6-13-27(3)21(28)12-16-29-17-23(26(2,18-29)15-11-22(27)29)32-33-25(36)31-20-9-7-19(30)8-10-20/h7-10,21-22H,5-6,11-18H2,1-4H3,(H2,31,33,36)/b32-23+/t21-,22-,26-,27+,28+,29-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 8.77E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537831
(CHEMBL4638258)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1ccc(cc1)C(C)(C)C)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:1.3.2:6| Show InChI InChI=1S/C33H49N3O2S/c1-8-38-27(37)32(7)17-9-16-31(6)24(32)15-19-33-20-26(30(5,21-33)18-14-25(31)33)35-36-28(39)34-23-12-10-22(11-13-23)29(2,3)4/h10-13,24-25H,8-9,14-21H2,1-7H3,(H2,34,36,39)/b35-26+/t24-,25-,30-,31+,32+,33-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 9.03E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537814
(CHEMBL4640092)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C[C@H]3OCc1cn(nn1)-c1ccccc1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C31H43N3O3/c1-5-36-27(35)30(4)15-9-14-29(3)24(30)13-17-31-18-26(28(2,21-31)16-12-25(29)31)37-20-22-19-34(33-32-22)23-10-7-6-8-11-23/h6-8,10-11,19,24-26H,5,9,12-18,20-21H2,1-4H3/t24-,25-,26+,28-,29+,30+,31-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.04E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50504370
(CHEMBL513767)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C[C@H]3O)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r| Show InChI InChI=1S/C22H36O3/c1-5-25-18(24)21(4)10-6-9-20(3)15(21)8-12-22-13-17(23)19(2,14-22)11-7-16(20)22/h15-17,23H,5-14H2,1-4H3/t15-,16-,17+,19-,20+,21+,22-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.27E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537824
(CHEMBL4645685)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1ccccc1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C29H41N3O2S/c1-5-34-24(33)28(4)15-9-14-27(3)21(28)13-17-29-18-23(26(2,19-29)16-12-22(27)29)31-32-25(35)30-20-10-7-6-8-11-20/h6-8,10-11,21-22H,5,9,12-19H2,1-4H3,(H2,30,32,35)/b31-23+/t21-,22-,26-,27+,28+,29-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.34E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537839
(CHEMBL4642705)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1ccc(cc1)C#N)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:1.3.2:6| Show InChI InChI=1S/C30H40N4O2S/c1-5-36-25(35)29(4)14-6-13-28(3)22(29)12-16-30-17-24(27(2,19-30)15-11-23(28)30)33-34-26(37)32-21-9-7-20(18-31)8-10-21/h7-10,22-23H,5-6,11-17,19H2,1-4H3,(H2,32,34,37)/b33-24+/t22-,23-,27-,28+,29+,30-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.36E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537819
(CHEMBL4641576)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C[C@H]3OCc1cn(nn1)-c1cccc(Cl)c1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C31H42ClN3O3/c1-5-37-27(36)30(4)13-7-12-29(3)24(30)11-15-31-17-26(28(2,20-31)14-10-25(29)31)38-19-22-18-35(34-33-22)23-9-6-8-21(32)16-23/h6,8-9,16,18,24-26H,5,7,10-15,17,19-20H2,1-4H3/t24-,25-,26+,28-,29+,30+,31-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.77E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537836
(CHEMBL4645081)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1cccc(OC)c1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:1.3.2:6| Show InChI InChI=1S/C30H43N3O3S/c1-6-36-25(34)29(4)14-8-13-28(3)22(29)12-16-30-18-24(27(2,19-30)15-11-23(28)30)32-33-26(37)31-20-9-7-10-21(17-20)35-5/h7,9-10,17,22-23H,6,8,11-16,18-19H2,1-5H3,(H2,31,33,37)/b32-24+/t22-,23-,27-,28+,29+,30-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.84E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537815
(CHEMBL4639084)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C[C@H]3OCc1cn(nn1)-c1ccc(OC)cc1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C32H45N3O4/c1-6-38-28(36)31(4)15-7-14-30(3)25(31)13-17-32-18-27(29(2,21-32)16-12-26(30)32)39-20-22-19-35(34-33-22)23-8-10-24(37-5)11-9-23/h8-11,19,25-27H,6-7,12-18,20-21H2,1-5H3/t25-,26-,27+,29-,30+,31+,32-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.93E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537817
(CHEMBL4637320)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C[C@H]3OCc1cn(nn1)-c1ccc(cc1)C(C)C)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C34H49N3O3/c1-7-39-30(38)33(6)16-8-15-32(5)27(33)14-18-34-19-29(31(4,22-34)17-13-28(32)34)40-21-25-20-37(36-35-25)26-11-9-24(10-12-26)23(2)3/h9-12,20,23,27-29H,7-8,13-19,21-22H2,1-6H3/t27-,28-,29+,31-,32+,33+,34-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.03E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537808
(CHEMBL4638079)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C[C@H]3OCc1cn(nn1)-c1ccc(Cl)cc1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C31H42ClN3O3/c1-5-37-27(36)30(4)14-6-13-29(3)24(30)12-16-31-17-26(28(2,20-31)15-11-25(29)31)38-19-22-18-35(34-33-22)23-9-7-21(32)8-10-23/h7-10,18,24-26H,5-6,11-17,19-20H2,1-4H3/t24-,25-,26+,28-,29+,30+,31-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.73E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537829
(CHEMBL4638756)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1ccc(F)cc1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:1.3.2:6| Show InChI InChI=1S/C29H40FN3O2S/c1-5-35-24(34)28(4)14-6-13-27(3)21(28)12-16-29-17-23(26(2,18-29)15-11-22(27)29)32-33-25(36)31-20-9-7-19(30)8-10-20/h7-10,21-22H,5-6,11-18H2,1-4H3,(H2,31,33,36)/b32-23+/t21-,22-,26-,27+,28+,29-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.75E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537813
(CHEMBL4641891)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C[C@H]3OCc1cn(Cc3ccccc3)nn1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C32H45N3O3/c1-5-37-28(36)31(4)15-9-14-30(3)25(31)13-17-32-18-27(29(2,22-32)16-12-26(30)32)38-21-24-20-35(34-33-24)19-23-10-7-6-8-11-23/h6-8,10-11,20,25-27H,5,9,12-19,21-22H2,1-4H3/t25-,26-,27+,29-,30+,31+,32-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.94E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537837
(CHEMBL4639437)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1cccc(c1)N(C)C)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:1.3.2:6| Show InChI InChI=1S/C31H46N4O2S/c1-7-37-26(36)30(4)15-9-14-29(3)23(30)13-17-31-19-25(28(2,20-31)16-12-24(29)31)33-34-27(38)32-21-10-8-11-22(18-21)35(5)6/h8,10-11,18,23-24H,7,9,12-17,19-20H2,1-6H3,(H2,32,34,38)/b33-25+/t23-,24-,28-,29+,30+,31-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.96E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537816
(CHEMBL4639518)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C[C@H]3OCC#C)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C25H38O3/c1-6-15-28-20-16-25-14-10-18-23(4,19(25)9-13-22(20,3)17-25)11-8-12-24(18,5)21(26)27-7-2/h1,18-20H,7-17H2,2-5H3/t18-,19-,20+,22-,23+,24+,25-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.24E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537835
(CHEMBL4633908)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1ccc(OC)cc1OC)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:1.3.2:6| Show InChI InChI=1S/C31H45N3O4S/c1-7-38-26(35)30(4)14-8-13-29(3)23(30)12-16-31-18-25(28(2,19-31)15-11-24(29)31)33-34-27(39)32-21-10-9-20(36-5)17-22(21)37-6/h9-10,17,23-24H,7-8,11-16,18-19H2,1-6H3,(H2,32,34,39)/b33-25+/t23-,24-,28-,29+,30+,31-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.36E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537821
(CHEMBL4634094)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C[C@H]3OCc1cn(nn1)-c1ccccc1C)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C32H45N3O3/c1-6-37-28(36)31(5)15-9-14-30(4)25(31)13-17-32-18-27(29(3,21-32)16-12-26(30)32)38-20-23-19-35(34-33-23)24-11-8-7-10-22(24)2/h7-8,10-11,19,25-27H,6,9,12-18,20-21H2,1-5H3/t25-,26-,27+,29-,30+,31+,32-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.45E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537820
(CHEMBL4647508)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C[C@H]3OCc1cn(nn1)-c1cccc(C)c1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C32H45N3O3/c1-6-37-28(36)31(5)14-8-13-30(4)25(31)12-16-32-18-27(29(3,21-32)15-11-26(30)32)38-20-23-19-35(34-33-23)24-10-7-9-22(2)17-24/h7,9-10,17,19,25-27H,6,8,11-16,18,20-21H2,1-5H3/t25-,26-,27+,29-,30+,31+,32-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 4.17E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537832
(CHEMBL4632627)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1ccc(cc1)C(C)C)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:1.3.2:6| Show InChI InChI=1S/C32H47N3O2S/c1-7-37-27(36)31(6)16-8-15-30(5)24(31)14-18-32-19-26(29(4,20-32)17-13-25(30)32)34-35-28(38)33-23-11-9-22(10-12-23)21(2)3/h9-12,21,24-25H,7-8,13-20H2,1-6H3,(H2,33,35,38)/b34-26+/t24-,25-,29-,30+,31+,32-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 5.49E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537825
(CHEMBL4634142)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1ccc(C)cc1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C30H43N3O2S/c1-6-35-25(34)29(5)15-7-14-28(4)22(29)13-17-30-18-24(27(3,19-30)16-12-23(28)30)32-33-26(36)31-21-10-8-20(2)9-11-21/h8-11,22-23H,6-7,12-19H2,1-5H3,(H2,31,33,36)/b32-24+/t22-,23-,27-,28+,29+,30-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 5.77E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of factor 10a (unknown origin) |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537826
(CHEMBL4645930)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1ccc(Cl)cc1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C29H40ClN3O2S/c1-5-35-24(34)28(4)14-6-13-27(3)21(28)12-16-29-17-23(26(2,18-29)15-11-22(27)29)32-33-25(36)31-20-9-7-19(30)8-10-20/h7-10,21-22H,5-6,11-18H2,1-4H3,(H2,31,33,36)/b32-23+/t21-,22-,26-,27+,28+,29-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | 7.5 | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Binding affinity to factor 10a (unknown origin) by SPR assay |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537827
(CHEMBL4635562)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1cccc(Cl)c1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C29H40ClN3O2S/c1-5-35-24(34)28(4)13-7-12-27(3)21(28)11-15-29-17-23(26(2,18-29)14-10-22(27)29)32-33-25(36)31-20-9-6-8-19(30)16-20/h6,8-9,16,21-22H,5,7,10-15,17-18H2,1-4H3,(H2,31,33,36)/b32-23+/t21-,22-,26-,27+,28+,29-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | 8.40 | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Binding affinity to factor 10a (unknown origin) by SPR assay |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537828
(CHEMBL4635937)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1ccccc1Cl)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C29H40ClN3O2S/c1-5-35-24(34)28(4)14-8-13-27(3)21(28)12-16-29-17-23(26(2,18-29)15-11-22(27)29)32-33-25(36)31-20-10-7-6-9-19(20)30/h6-7,9-10,21-22H,5,8,11-18H2,1-4H3,(H2,31,33,36)/b32-23+/t21-,22-,26-,27+,28+,29-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | 1.90 | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Binding affinity to factor 10a (unknown origin) assessed as dissociation rate constant by SPR assay |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537826
(CHEMBL4645930)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1ccc(Cl)cc1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C29H40ClN3O2S/c1-5-35-24(34)28(4)14-6-13-27(3)21(28)12-16-29-17-23(26(2,18-29)15-11-22(27)29)32-33-25(36)31-20-9-7-19(30)8-10-20/h7-10,21-22H,5-6,11-18H2,1-4H3,(H2,31,33,36)/b32-23+/t21-,22-,26-,27+,28+,29-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | 1.5 | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Binding affinity to factor 10a (unknown origin) assessed as dissociation rate constant by SPR assay |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537828
(CHEMBL4635937)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1ccccc1Cl)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C29H40ClN3O2S/c1-5-35-24(34)28(4)14-8-13-27(3)21(28)12-16-29-17-23(26(2,18-29)15-11-22(27)29)32-33-25(36)31-20-10-7-6-9-19(20)30/h6-7,9-10,21-22H,5,8,11-18H2,1-4H3,(H2,31,33,36)/b32-23+/t21-,22-,26-,27+,28+,29-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Binding affinity to factor 10a (unknown origin) by SPR assay |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50537827
(CHEMBL4635562)Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1cccc(Cl)c1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C29H40ClN3O2S/c1-5-35-24(34)28(4)13-7-12-27(3)21(28)11-15-29-17-23(26(2,18-29)14-10-22(27)29)32-33-25(36)31-20-9-6-8-19(30)16-20/h6,8-9,16,21-22H,5,7,10-15,17-18H2,1-4H3,(H2,31,33,36)/b32-23+/t21-,22-,26-,27+,28+,29-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | 1.60 | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Binding affinity to factor 10a (unknown origin) assessed as dissociation rate constant by SPR assay |
Bioorg Med Chem Lett 30: (2020)
Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M |
More data for this
Ligand-Target Pair | |
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