Found 64 hits Enz. Inhib. hit(s) with all data for entry = 50002797 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 |
|---|
Cathepsin B
(Homo sapiens (Human)) | BDBM50463145
(CHEMBL4244085)Show SMILES CCOC(=O)\C=C\C=C\C(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C31H37N3O6/c1-2-40-29(36)16-10-9-15-28(35)26(18-17-24-11-5-3-6-12-24)32-30(37)27(23-25-13-7-4-8-14-25)33-31(38)34-19-21-39-22-20-34/h3-16,26-27H,2,17-23H2,1H3,(H,32,37)(H,33,38)/b15-9+,16-10+/t26-,27-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| Article
PubMed
| 1.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin B using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50463145
(CHEMBL4244085)Show SMILES CCOC(=O)\C=C\C=C\C(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C31H37N3O6/c1-2-40-29(36)16-10-9-15-28(35)26(18-17-24-11-5-3-6-12-24)32-30(37)27(23-25-13-7-4-8-14-25)33-31(38)34-19-21-39-22-20-34/h3-16,26-27H,2,17-23H2,1H3,(H,32,37)(H,33,38)/b15-9+,16-10+/t26-,27-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 7.80E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin L using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50463157
(CHEMBL4244656)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C28H34N2O6/c1-4-35-26(32)16-15-25(31)23(17-20(2)3)29-27(33)24(18-21-11-7-5-8-12-21)30-28(34)36-19-22-13-9-6-10-14-22/h5-16,20,23-24H,4,17-19H2,1-3H3,(H,29,33)(H,30,34)/b16-15+/t23-,24-/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 | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin L using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50463142
(CHEMBL4238441)Show SMILES CCOC(=O)\C=C\C(=O)[C@@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C28H34N2O6/c1-4-35-26(32)16-15-25(31)23(17-20(2)3)29-27(33)24(18-21-11-7-5-8-12-21)30-28(34)36-19-22-13-9-6-10-14-22/h5-16,20,23-24H,4,17-19H2,1-3H3,(H,29,33)(H,30,34)/b16-15+/t23-,24+/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 | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin L using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cruzipain
(Trypanosoma cruzi) | BDBM50463157
(CHEMBL4244656)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C28H34N2O6/c1-4-35-26(32)16-15-25(31)23(17-20(2)3)29-27(33)24(18-21-11-7-5-8-12-21)30-28(34)36-19-22-13-9-6-10-14-22/h5-16,20,23-24H,4,17-19H2,1-3H3,(H,29,33)(H,30,34)/b16-15+/t23-,24-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Trypanosoma cruzi cruzain |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cruzipain
(Trypanosoma cruzi) | BDBM50463142
(CHEMBL4238441)Show SMILES CCOC(=O)\C=C\C(=O)[C@@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C28H34N2O6/c1-4-35-26(32)16-15-25(31)23(17-20(2)3)29-27(33)24(18-21-11-7-5-8-12-21)30-28(34)36-19-22-13-9-6-10-14-22/h5-16,20,23-24H,4,17-19H2,1-3H3,(H,29,33)(H,30,34)/b16-15+/t23-,24+/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Trypanosoma cruzi cruzain |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cysteine protease
(Trypanosoma brucei rhodesiense) | BDBM50463157
(CHEMBL4244656)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C28H34N2O6/c1-4-35-26(32)16-15-25(31)23(17-20(2)3)29-27(33)24(18-21-11-7-5-8-12-21)30-28(34)36-19-22-13-9-6-10-14-22/h5-16,20,23-24H,4,17-19H2,1-3H3,(H,29,33)(H,30,34)/b16-15+/t23-,24-/m0/s1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Trypanosoma brucei rhodesiense rhodesain using Cbz-Phe-Arg-AMC as substrate measured for 30 mins by fluorescence method |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cysteine protease
(Trypanosoma brucei rhodesiense) | BDBM50463154
(CHEMBL4251480)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C32H34N2O6/c1-2-39-30(36)21-20-29(35)27(19-18-24-12-6-3-7-13-24)33-31(37)28(22-25-14-8-4-9-15-25)34-32(38)40-23-26-16-10-5-11-17-26/h3-17,20-21,27-28H,2,18-19,22-23H2,1H3,(H,33,37)(H,34,38)/b21-20+/t27-,28-/m0/s1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Trypanosoma brucei rhodesiense rhodesain using Cbz-Phe-Arg-AMC as substrate measured for 30 mins by fluorescence method |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cysteine protease
(Trypanosoma brucei rhodesiense) | BDBM50463142
(CHEMBL4238441)Show SMILES CCOC(=O)\C=C\C(=O)[C@@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C28H34N2O6/c1-4-35-26(32)16-15-25(31)23(17-20(2)3)29-27(33)24(18-21-11-7-5-8-12-21)30-28(34)36-19-22-13-9-6-10-14-22/h5-16,20,23-24H,4,17-19H2,1-3H3,(H,29,33)(H,30,34)/b16-15+/t23-,24+/m1/s1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Trypanosoma brucei rhodesiense rhodesain using Cbz-Phe-Arg-AMC as substrate measured for 30 mins by fluorescence method |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cathepsin B
(Homo sapiens (Human)) | BDBM50463157
(CHEMBL4244656)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C28H34N2O6/c1-4-35-26(32)16-15-25(31)23(17-20(2)3)29-27(33)24(18-21-11-7-5-8-12-21)30-28(34)36-19-22-13-9-6-10-14-22/h5-16,20,23-24H,4,17-19H2,1-3H3,(H,29,33)(H,30,34)/b16-15+/t23-,24-/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 | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin B using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cathepsin B
(Homo sapiens (Human)) | BDBM50463143
(CHEMBL4245127)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C29H36N2O6/c1-4-36-27(33)18-17-26(32)24(16-15-22-11-7-5-8-12-22)30-28(34)25(19-21(2)3)31-29(35)37-20-23-13-9-6-10-14-23/h5-14,17-18,21,24-25H,4,15-16,19-20H2,1-3H3,(H,30,34)(H,31,35)/b18-17+/t24-,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 | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin B using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50463154
(CHEMBL4251480)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C32H34N2O6/c1-2-39-30(36)21-20-29(35)27(19-18-24-12-6-3-7-13-24)33-31(37)28(22-25-14-8-4-9-15-25)34-32(38)40-23-26-16-10-5-11-17-26/h3-17,20-21,27-28H,2,18-19,22-23H2,1H3,(H,33,37)(H,34,38)/b21-20+/t27-,28-/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 | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin L using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cysteine proteinase falcipain 2a
(Plasmodium falciparum) | BDBM50463154
(CHEMBL4251480)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C32H34N2O6/c1-2-39-30(36)21-20-29(35)27(19-18-24-12-6-3-7-13-24)33-31(37)28(22-25-14-8-4-9-15-25)34-32(38)40-23-26-16-10-5-11-17-26/h3-17,20-21,27-28H,2,18-19,22-23H2,1H3,(H,33,37)(H,34,38)/b21-20+/t27-,28-/m0/s1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 60 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Plasmodium falciparum falcipain-2 using Cbz-Phe-Arg-AMC as substrate measured for 15 mins by spectrofluorimetric method |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cathepsin B
(Homo sapiens (Human)) | BDBM50463142
(CHEMBL4238441)Show SMILES CCOC(=O)\C=C\C(=O)[C@@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C28H34N2O6/c1-4-35-26(32)16-15-25(31)23(17-20(2)3)29-27(33)24(18-21-11-7-5-8-12-21)30-28(34)36-19-22-13-9-6-10-14-22/h5-16,20,23-24H,4,17-19H2,1-3H3,(H,29,33)(H,30,34)/b16-15+/t23-,24+/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 | 60 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin B using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cathepsin B
(Homo sapiens (Human)) | BDBM50463152
(CHEMBL4242138)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C29H35N3O6/c1-2-38-27(34)16-15-26(33)24(14-13-22-9-5-3-6-10-22)30-28(35)25(21-23-11-7-4-8-12-23)31-29(36)32-17-19-37-20-18-32/h3-12,15-16,24-25H,2,13-14,17-21H2,1H3,(H,30,35)(H,31,36)/b16-15+/t24-,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 | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin B using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cathepsin B
(Homo sapiens (Human)) | BDBM50463154
(CHEMBL4251480)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C32H34N2O6/c1-2-39-30(36)21-20-29(35)27(19-18-24-12-6-3-7-13-24)33-31(37)28(22-25-14-8-4-9-15-25)34-32(38)40-23-26-16-10-5-11-17-26/h3-17,20-21,27-28H,2,18-19,22-23H2,1H3,(H,33,37)(H,34,38)/b21-20+/t27-,28-/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 | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin B using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cathepsin B
(Homo sapiens (Human)) | BDBM50463149
(CHEMBL4248915)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C22H30N2O6/c1-5-29-20(26)12-11-19(25)16(4)23-21(27)18(13-15(2)3)24-22(28)30-14-17-9-7-6-8-10-17/h6-12,15-16,18H,5,13-14H2,1-4H3,(H,23,27)(H,24,28)/b12-11+/t16-,18-/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 | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin B using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cathepsin B
(Homo sapiens (Human)) | BDBM50463148
(CHEMBL4247707)Show SMILES CCOC(=O)\C=C\C(=O)[C@@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C29H35N3O6/c1-2-38-27(34)16-15-26(33)24(14-13-22-9-5-3-6-10-22)30-28(35)25(21-23-11-7-4-8-12-23)31-29(36)32-17-19-37-20-18-32/h3-12,15-16,24-25H,2,13-14,17-21H2,1H3,(H,30,35)(H,31,36)/b16-15+/t24-,25+/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 | 80 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin B using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50463146
(CHEMBL4240920)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C25H28N2O6/c1-3-32-23(29)15-14-22(28)18(2)26-24(30)21(16-19-10-6-4-7-11-19)27-25(31)33-17-20-12-8-5-9-13-20/h4-15,18,21H,3,16-17H2,1-2H3,(H,26,30)(H,27,31)/b15-14+/t18-,21-/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 | 80 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin L using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cruzipain
(Trypanosoma cruzi) | BDBM50463143
(CHEMBL4245127)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C29H36N2O6/c1-4-36-27(33)18-17-26(32)24(16-15-22-11-7-5-8-12-22)30-28(34)25(19-21(2)3)31-29(35)37-20-23-13-9-6-10-14-23/h5-14,17-18,21,24-25H,4,15-16,19-20H2,1-3H3,(H,30,34)(H,31,35)/b18-17+/t24-,25-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 80 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Trypanosoma cruzi cruzain |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50463147
(CHEMBL4237990)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C22H37N3O6/c1-6-31-20(27)8-7-19(26)17(13-15(2)3)23-21(28)18(14-16(4)5)24-22(29)25-9-11-30-12-10-25/h7-8,15-18H,6,9-14H2,1-5H3,(H,23,28)(H,24,29)/b8-7+/t17-,18-/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 | 90 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin L using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cathepsin B
(Homo sapiens (Human)) | BDBM50463147
(CHEMBL4237990)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C22H37N3O6/c1-6-31-20(27)8-7-19(26)17(13-15(2)3)23-21(28)18(14-16(4)5)24-22(29)25-9-11-30-12-10-25/h7-8,15-18H,6,9-14H2,1-5H3,(H,23,28)(H,24,29)/b8-7+/t17-,18-/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 | 90 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin B using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cysteine protease
(Trypanosoma brucei rhodesiense) | BDBM50463147
(CHEMBL4237990)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C22H37N3O6/c1-6-31-20(27)8-7-19(26)17(13-15(2)3)23-21(28)18(14-16(4)5)24-22(29)25-9-11-30-12-10-25/h7-8,15-18H,6,9-14H2,1-5H3,(H,23,28)(H,24,29)/b8-7+/t17-,18-/m0/s1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 110 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Trypanosoma brucei rhodesiense rhodesain using Cbz-Phe-Arg-AMC as substrate measured for 30 mins by fluorescence method |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cathepsin B
(Homo sapiens (Human)) | BDBM50463151
(CHEMBL4249696)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C26H37N3O6/c1-4-35-24(31)13-12-23(30)21(11-10-20-8-6-5-7-9-20)27-25(32)22(18-19(2)3)28-26(33)29-14-16-34-17-15-29/h5-9,12-13,19,21-22H,4,10-11,14-18H2,1-3H3,(H,27,32)(H,28,33)/b13-12+/t21-,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 | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin B using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cysteine protease
(Trypanosoma brucei rhodesiense) | BDBM50463151
(CHEMBL4249696)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C26H37N3O6/c1-4-35-24(31)13-12-23(30)21(11-10-20-8-6-5-7-9-20)27-25(32)22(18-19(2)3)28-26(33)29-14-16-34-17-15-29/h5-9,12-13,19,21-22H,4,10-11,14-18H2,1-3H3,(H,27,32)(H,28,33)/b13-12+/t21-,22-/m0/s1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Trypanosoma brucei rhodesiense rhodesain using Cbz-Phe-Arg-AMC as substrate measured for 30 mins by fluorescence method |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cathepsin B
(Homo sapiens (Human)) | BDBM50463146
(CHEMBL4240920)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C25H28N2O6/c1-3-32-23(29)15-14-22(28)18(2)26-24(30)21(16-19-10-6-4-7-11-19)27-25(31)33-17-20-12-8-5-9-13-20/h4-15,18,21H,3,16-17H2,1-2H3,(H,26,30)(H,27,31)/b15-14+/t18-,21-/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 | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin B using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cysteine protease
(Trypanosoma brucei rhodesiense) | BDBM50463143
(CHEMBL4245127)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C29H36N2O6/c1-4-36-27(33)18-17-26(32)24(16-15-22-11-7-5-8-12-22)30-28(34)25(19-21(2)3)31-29(35)37-20-23-13-9-6-10-14-23/h5-14,17-18,21,24-25H,4,15-16,19-20H2,1-3H3,(H,30,34)(H,31,35)/b18-17+/t24-,25-/m0/s1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 145 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Trypanosoma brucei rhodesiense rhodesain using Cbz-Phe-Arg-AMC as substrate measured for 30 mins by fluorescence method |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cysteine protease
(Trypanosoma brucei rhodesiense) | BDBM50463148
(CHEMBL4247707)Show SMILES CCOC(=O)\C=C\C(=O)[C@@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C29H35N3O6/c1-2-38-27(34)16-15-26(33)24(14-13-22-9-5-3-6-10-22)30-28(35)25(21-23-11-7-4-8-12-23)31-29(36)32-17-19-37-20-18-32/h3-12,15-16,24-25H,2,13-14,17-21H2,1H3,(H,30,35)(H,31,36)/b16-15+/t24-,25+/m1/s1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 150 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Trypanosoma brucei rhodesiense rhodesain using Cbz-Phe-Arg-AMC as substrate measured for 30 mins by fluorescence method |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cysteine protease
(Trypanosoma brucei rhodesiense) | BDBM50463152
(CHEMBL4242138)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C29H35N3O6/c1-2-38-27(34)16-15-26(33)24(14-13-22-9-5-3-6-10-22)30-28(35)25(21-23-11-7-4-8-12-23)31-29(36)32-17-19-37-20-18-32/h3-12,15-16,24-25H,2,13-14,17-21H2,1H3,(H,30,35)(H,31,36)/b16-15+/t24-,25-/m0/s1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 150 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Trypanosoma brucei rhodesiense rhodesain using Cbz-Phe-Arg-AMC as substrate measured for 30 mins by fluorescence method |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50463152
(CHEMBL4242138)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C29H35N3O6/c1-2-38-27(34)16-15-26(33)24(14-13-22-9-5-3-6-10-22)30-28(35)25(21-23-11-7-4-8-12-23)31-29(36)32-17-19-37-20-18-32/h3-12,15-16,24-25H,2,13-14,17-21H2,1H3,(H,30,35)(H,31,36)/b16-15+/t24-,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 | 180 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin L using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cysteine proteinase falcipain 2a
(Plasmodium falciparum) | BDBM50463146
(CHEMBL4240920)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C25H28N2O6/c1-3-32-23(29)15-14-22(28)18(2)26-24(30)21(16-19-10-6-4-7-11-19)27-25(31)33-17-20-12-8-5-9-13-20/h4-15,18,21H,3,16-17H2,1-2H3,(H,26,30)(H,27,31)/b15-14+/t18-,21-/m0/s1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 190 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Plasmodium falciparum falcipain-2 using Cbz-Phe-Arg-AMC as substrate measured for 15 mins by spectrofluorimetric method |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cruzipain
(Trypanosoma cruzi) | BDBM50463147
(CHEMBL4237990)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C22H37N3O6/c1-6-31-20(27)8-7-19(26)17(13-15(2)3)23-21(28)18(14-16(4)5)24-22(29)25-9-11-30-12-10-25/h7-8,15-18H,6,9-14H2,1-5H3,(H,23,28)(H,24,29)/b8-7+/t17-,18-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Trypanosoma cruzi cruzain |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50463151
(CHEMBL4249696)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C26H37N3O6/c1-4-35-24(31)13-12-23(30)21(11-10-20-8-6-5-7-9-20)27-25(32)22(18-19(2)3)28-26(33)29-14-16-34-17-15-29/h5-9,12-13,19,21-22H,4,10-11,14-18H2,1-3H3,(H,27,32)(H,28,33)/b13-12+/t21-,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 | 210 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin L using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50463143
(CHEMBL4245127)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C29H36N2O6/c1-4-36-27(33)18-17-26(32)24(16-15-22-11-7-5-8-12-22)30-28(34)25(19-21(2)3)31-29(35)37-20-23-13-9-6-10-14-23/h5-14,17-18,21,24-25H,4,15-16,19-20H2,1-3H3,(H,30,34)(H,31,35)/b18-17+/t24-,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 | 260 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin L using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cruzipain
(Trypanosoma cruzi) | BDBM50463146
(CHEMBL4240920)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C25H28N2O6/c1-3-32-23(29)15-14-22(28)18(2)26-24(30)21(16-19-10-6-4-7-11-19)27-25(31)33-17-20-12-8-5-9-13-20/h4-15,18,21H,3,16-17H2,1-2H3,(H,26,30)(H,27,31)/b15-14+/t18-,21-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 300 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Trypanosoma cruzi cruzain |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cruzipain
(Trypanosoma cruzi) | BDBM50463152
(CHEMBL4242138)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C29H35N3O6/c1-2-38-27(34)16-15-26(33)24(14-13-22-9-5-3-6-10-22)30-28(35)25(21-23-11-7-4-8-12-23)31-29(36)32-17-19-37-20-18-32/h3-12,15-16,24-25H,2,13-14,17-21H2,1H3,(H,30,35)(H,31,36)/b16-15+/t24-,25-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 300 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Trypanosoma cruzi cruzain |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cruzipain
(Trypanosoma cruzi) | BDBM50463148
(CHEMBL4247707)Show SMILES CCOC(=O)\C=C\C(=O)[C@@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C29H35N3O6/c1-2-38-27(34)16-15-26(33)24(14-13-22-9-5-3-6-10-22)30-28(35)25(21-23-11-7-4-8-12-23)31-29(36)32-17-19-37-20-18-32/h3-12,15-16,24-25H,2,13-14,17-21H2,1H3,(H,30,35)(H,31,36)/b16-15+/t24-,25+/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 330 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Trypanosoma cruzi cruzain |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cruzipain
(Trypanosoma cruzi) | BDBM50463151
(CHEMBL4249696)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C26H37N3O6/c1-4-35-24(31)13-12-23(30)21(11-10-20-8-6-5-7-9-20)27-25(32)22(18-19(2)3)28-26(33)29-14-16-34-17-15-29/h5-9,12-13,19,21-22H,4,10-11,14-18H2,1-3H3,(H,27,32)(H,28,33)/b13-12+/t21-,22-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 340 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Trypanosoma cruzi cruzain |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50463149
(CHEMBL4248915)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C22H30N2O6/c1-5-29-20(26)12-11-19(25)16(4)23-21(27)18(13-15(2)3)24-22(28)30-14-17-9-7-6-8-10-17/h6-12,15-16,18H,5,13-14H2,1-4H3,(H,23,27)(H,24,28)/b12-11+/t16-,18-/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 | 500 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin L using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cysteine protease
(Trypanosoma brucei rhodesiense) | BDBM50463145
(CHEMBL4244085)Show SMILES CCOC(=O)\C=C\C=C\C(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C31H37N3O6/c1-2-40-29(36)16-10-9-15-28(35)26(18-17-24-11-5-3-6-12-24)32-30(37)27(23-25-13-7-4-8-14-25)33-31(38)34-19-21-39-22-20-34/h3-16,26-27H,2,17-23H2,1H3,(H,32,37)(H,33,38)/b15-9+,16-10+/t26-,27-/m0/s1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 560 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Trypanosoma brucei rhodesiense rhodesain using Cbz-Phe-Arg-AMC as substrate measured for 30 mins by fluorescence method |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cysteine proteinase falcipain 2a
(Plasmodium falciparum) | BDBM50463143
(CHEMBL4245127)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C29H36N2O6/c1-4-36-27(33)18-17-26(32)24(16-15-22-11-7-5-8-12-22)30-28(34)25(19-21(2)3)31-29(35)37-20-23-13-9-6-10-14-23/h5-14,17-18,21,24-25H,4,15-16,19-20H2,1-3H3,(H,30,34)(H,31,35)/b18-17+/t24-,25-/m0/s1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 580 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Plasmodium falciparum falcipain-2 using Cbz-Phe-Arg-AMC as substrate measured for 15 mins by spectrofluorimetric method |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cysteine protease
(Trypanosoma brucei rhodesiense) | BDBM50463146
(CHEMBL4240920)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C25H28N2O6/c1-3-32-23(29)15-14-22(28)18(2)26-24(30)21(16-19-10-6-4-7-11-19)27-25(31)33-17-20-12-8-5-9-13-20/h4-15,18,21H,3,16-17H2,1-2H3,(H,26,30)(H,27,31)/b15-14+/t18-,21-/m0/s1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 590 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Trypanosoma brucei rhodesiense rhodesain using Cbz-Phe-Arg-AMC as substrate measured for 30 mins by fluorescence method |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cruzipain
(Trypanosoma cruzi) | BDBM50463149
(CHEMBL4248915)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C22H30N2O6/c1-5-29-20(26)12-11-19(25)16(4)23-21(27)18(13-15(2)3)24-22(28)30-14-17-9-7-6-8-10-17/h6-12,15-16,18H,5,13-14H2,1-4H3,(H,23,27)(H,24,28)/b12-11+/t16-,18-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 630 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Trypanosoma cruzi cruzain |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cysteine protease
(Trypanosoma brucei rhodesiense) | BDBM50463149
(CHEMBL4248915)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C22H30N2O6/c1-5-29-20(26)12-11-19(25)16(4)23-21(27)18(13-15(2)3)24-22(28)30-14-17-9-7-6-8-10-17/h6-12,15-16,18H,5,13-14H2,1-4H3,(H,23,27)(H,24,28)/b12-11+/t16-,18-/m0/s1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 800 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Trypanosoma brucei rhodesiense rhodesain using Cbz-Phe-Arg-AMC as substrate measured for 30 mins by fluorescence method |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cathepsin B
(Homo sapiens (Human)) | BDBM50463156
(CHEMBL4250264)Show SMILES CCOC(=O)\C=C\[C@@H](O)[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C29H37N3O6/c1-2-38-27(34)16-15-26(33)24(14-13-22-9-5-3-6-10-22)30-28(35)25(21-23-11-7-4-8-12-23)31-29(36)32-17-19-37-20-18-32/h3-12,15-16,24-26,33H,2,13-14,17-21H2,1H3,(H,30,35)(H,31,36)/b16-15+/t24-,25-,26+/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 | 1.13E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin B using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cysteine protease
(Trypanosoma brucei rhodesiense) | BDBM50463156
(CHEMBL4250264)Show SMILES CCOC(=O)\C=C\[C@@H](O)[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C29H37N3O6/c1-2-38-27(34)16-15-26(33)24(14-13-22-9-5-3-6-10-22)30-28(35)25(21-23-11-7-4-8-12-23)31-29(36)32-17-19-37-20-18-32/h3-12,15-16,24-26,33H,2,13-14,17-21H2,1H3,(H,30,35)(H,31,36)/b16-15+/t24-,25-,26+/m0/s1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.13E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Trypanosoma brucei rhodesiense rhodesain using Cbz-Phe-Arg-AMC as substrate measured for 30 mins by fluorescence method |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cysteine proteinase falcipain 2a
(Plasmodium falciparum) | BDBM50463149
(CHEMBL4248915)Show SMILES CCOC(=O)\C=C\C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C22H30N2O6/c1-5-29-20(26)12-11-19(25)16(4)23-21(27)18(13-15(2)3)24-22(28)30-14-17-9-7-6-8-10-17/h6-12,15-16,18H,5,13-14H2,1-4H3,(H,23,27)(H,24,28)/b12-11+/t16-,18-/m0/s1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Plasmodium falciparum falcipain-2 using Cbz-Phe-Arg-AMC as substrate measured for 15 mins by spectrofluorimetric method |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50463145
(CHEMBL4244085)Show SMILES CCOC(=O)\C=C\C=C\C(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C31H37N3O6/c1-2-40-29(36)16-10-9-15-28(35)26(18-17-24-11-5-3-6-12-24)32-30(37)27(23-25-13-7-4-8-14-25)33-31(38)34-19-21-39-22-20-34/h3-16,26-27H,2,17-23H2,1H3,(H,32,37)(H,33,38)/b15-9+,16-10+/t26-,27-/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 | 1.49E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin L using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50463148
(CHEMBL4247707)Show SMILES CCOC(=O)\C=C\C(=O)[C@@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C29H35N3O6/c1-2-38-27(34)16-15-26(33)24(14-13-22-9-5-3-6-10-22)30-28(35)25(21-23-11-7-4-8-12-23)31-29(36)32-17-19-37-20-18-32/h3-12,15-16,24-25H,2,13-14,17-21H2,1H3,(H,30,35)(H,31,36)/b16-15+/t24-,25+/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 | >2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin L using Cbz-Phe-Arg-AMC as substrate |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
Cruzipain
(Trypanosoma cruzi) | BDBM50463145
(CHEMBL4244085)Show SMILES CCOC(=O)\C=C\C=C\C(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C31H37N3O6/c1-2-40-29(36)16-10-9-15-28(35)26(18-17-24-11-5-3-6-12-24)32-30(37)27(23-25-13-7-4-8-14-25)33-31(38)34-19-21-39-22-20-34/h3-16,26-27H,2,17-23H2,1H3,(H,32,37)(H,33,38)/b15-9+,16-10+/t26-,27-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Jaume I
Curated by ChEMBL
| Assay Description
Inhibition of Trypanosoma cruzi cruzain |
Bioorg Med Chem 26: 4624-4634 (2018)
Article DOI: 10.1016/j.bmc.2018.07.015
BindingDB Entry DOI: 10.7270/Q29S1TPM |
More data for this
Ligand-Target Pair | |
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