Found 4 hits of ki for monomerid = 50097755 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)) | BDBM50097755
(CHEMBL164249 | N-[[(4-Aminomethyl-cyclohexylmethyl...)Show SMILES NCC1CCC(CNC(=O)C(NC(=O)c2cccc(c2)C(N)=N)c2cccc(Cl)c2)CC1 |(13.7,-5.77,;12.28,-6.39,;11.06,-5.47,;10.09,-3.97,;8.24,-4.79,;6.77,-4.39,;5.44,-5.19,;4.09,-4.44,;2.78,-5.21,;2.78,-6.75,;1.45,-4.46,;.1,-5.23,;-1.23,-4.46,;-1.24,-2.92,;-2.56,-5.23,;-3.9,-4.46,;-5.23,-5.25,;-5.23,-6.79,;-3.9,-7.56,;-2.56,-6.79,;-3.9,-9.1,;-5.23,-9.87,;-2.56,-9.87,;1.43,-2.92,;.1,-2.15,;.1,-.61,;1.43,.16,;2.78,-.61,;4.09,.18,;2.78,-2.13,;7.73,-5.89,;9.67,-5.07,)| Show InChI InChI=1S/C24H30ClN5O2/c25-20-6-2-3-17(12-20)21(24(32)29-14-16-9-7-15(13-26)8-10-16)30-23(31)19-5-1-4-18(11-19)22(27)28/h1-6,11-12,15-16,21H,7-10,13-14,26H2,(H3,27,28)(H,29,32)(H,30,31) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| 300 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Prosthetics Molecular Design
Curated by ChEMBL
| Assay Description Binding affinity against human coagulation factor Xa |
Bioorg Med Chem Lett 11: 733-6 (2001)
BindingDB Entry DOI: 10.7270/Q2M32V0B |
More data for this Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM50097755
(CHEMBL164249 | N-[[(4-Aminomethyl-cyclohexylmethyl...)Show SMILES NCC1CCC(CNC(=O)C(NC(=O)c2cccc(c2)C(N)=N)c2cccc(Cl)c2)CC1 |(13.7,-5.77,;12.28,-6.39,;11.06,-5.47,;10.09,-3.97,;8.24,-4.79,;6.77,-4.39,;5.44,-5.19,;4.09,-4.44,;2.78,-5.21,;2.78,-6.75,;1.45,-4.46,;.1,-5.23,;-1.23,-4.46,;-1.24,-2.92,;-2.56,-5.23,;-3.9,-4.46,;-5.23,-5.25,;-5.23,-6.79,;-3.9,-7.56,;-2.56,-6.79,;-3.9,-9.1,;-5.23,-9.87,;-2.56,-9.87,;1.43,-2.92,;.1,-2.15,;.1,-.61,;1.43,.16,;2.78,-.61,;4.09,.18,;2.78,-2.13,;7.73,-5.89,;9.67,-5.07,)| Show InChI InChI=1S/C24H30ClN5O2/c25-20-6-2-3-17(12-20)21(24(32)29-14-16-9-7-15(13-26)8-10-16)30-23(31)19-5-1-4-18(11-19)22(27)28/h1-6,11-12,15-16,21H,7-10,13-14,26H2,(H3,27,28)(H,29,32)(H,30,31) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| 300 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Prosthetics Molecular Design
Curated by ChEMBL
| Assay Description Binding affinity against human coagulation factor Xa |
Bioorg Med Chem Lett 11: 733-6 (2001)
BindingDB Entry DOI: 10.7270/Q2M32V0B |
More data for this Ligand-Target Pair | |
Serine protease 1
(Homo sapiens (Human)) | BDBM50097755
(CHEMBL164249 | N-[[(4-Aminomethyl-cyclohexylmethyl...)Show SMILES NCC1CCC(CNC(=O)C(NC(=O)c2cccc(c2)C(N)=N)c2cccc(Cl)c2)CC1 |(13.7,-5.77,;12.28,-6.39,;11.06,-5.47,;10.09,-3.97,;8.24,-4.79,;6.77,-4.39,;5.44,-5.19,;4.09,-4.44,;2.78,-5.21,;2.78,-6.75,;1.45,-4.46,;.1,-5.23,;-1.23,-4.46,;-1.24,-2.92,;-2.56,-5.23,;-3.9,-4.46,;-5.23,-5.25,;-5.23,-6.79,;-3.9,-7.56,;-2.56,-6.79,;-3.9,-9.1,;-5.23,-9.87,;-2.56,-9.87,;1.43,-2.92,;.1,-2.15,;.1,-.61,;1.43,.16,;2.78,-.61,;4.09,.18,;2.78,-2.13,;7.73,-5.89,;9.67,-5.07,)| Show InChI InChI=1S/C24H30ClN5O2/c25-20-6-2-3-17(12-20)21(24(32)29-14-16-9-7-15(13-26)8-10-16)30-23(31)19-5-1-4-18(11-19)22(27)28/h1-6,11-12,15-16,21H,7-10,13-14,26H2,(H3,27,28)(H,29,32)(H,30,31) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| 5.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Prosthetics Molecular Design
Curated by ChEMBL
| Assay Description Binding affinity against human trypsin |
Bioorg Med Chem Lett 11: 733-6 (2001)
BindingDB Entry DOI: 10.7270/Q2M32V0B |
More data for this Ligand-Target Pair | |
Serine protease 1
(Homo sapiens (Human)) | BDBM50097755
(CHEMBL164249 | N-[[(4-Aminomethyl-cyclohexylmethyl...)Show SMILES NCC1CCC(CNC(=O)C(NC(=O)c2cccc(c2)C(N)=N)c2cccc(Cl)c2)CC1 |(13.7,-5.77,;12.28,-6.39,;11.06,-5.47,;10.09,-3.97,;8.24,-4.79,;6.77,-4.39,;5.44,-5.19,;4.09,-4.44,;2.78,-5.21,;2.78,-6.75,;1.45,-4.46,;.1,-5.23,;-1.23,-4.46,;-1.24,-2.92,;-2.56,-5.23,;-3.9,-4.46,;-5.23,-5.25,;-5.23,-6.79,;-3.9,-7.56,;-2.56,-6.79,;-3.9,-9.1,;-5.23,-9.87,;-2.56,-9.87,;1.43,-2.92,;.1,-2.15,;.1,-.61,;1.43,.16,;2.78,-.61,;4.09,.18,;2.78,-2.13,;7.73,-5.89,;9.67,-5.07,)| Show InChI InChI=1S/C24H30ClN5O2/c25-20-6-2-3-17(12-20)21(24(32)29-14-16-9-7-15(13-26)8-10-16)30-23(31)19-5-1-4-18(11-19)22(27)28/h1-6,11-12,15-16,21H,7-10,13-14,26H2,(H3,27,28)(H,29,32)(H,30,31) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| 5.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Prosthetics Molecular Design
Curated by ChEMBL
| Assay Description Binding affinity against human trypsin |
Bioorg Med Chem Lett 11: 733-6 (2001)
BindingDB Entry DOI: 10.7270/Q2M32V0B |
More data for this Ligand-Target Pair | |