Found 138 hits with Last Name = 'johnson' and Initial = 'pr' 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 |
|---|
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173960
((2S,4S)-1-((R)-2-amino-3-methyl-3-(pyridin-2-ylmet...)Show SMILES CC(C)(SCc1ccccn1)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N Show InChI InChI=1S/C16H21FN4OS/c1-16(2,23-10-12-5-3-4-6-20-12)14(19)15(22)21-9-11(17)7-13(21)8-18/h3-6,11,13-14H,7,9-10,19H2,1-2H3/t11-,13-,14+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173976
((2S,4S)-1-((R)-2-amino-3-methyl-3-(pyridin-3-ylmet...)Show SMILES CC(C)(SCc1cccnc1)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N Show InChI InChI=1S/C16H21FN4OS/c1-16(2,23-10-11-4-3-5-20-8-11)14(19)15(22)21-9-12(17)6-13(21)7-18/h3-5,8,12-14H,6,9-10,19H2,1-2H3/t12-,13-,14+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 18 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173983
((2S,4S)-1-((R)-2-amino-3-methyl-3-(3-phenylpropylt...)Show SMILES CC(C)(SCCCc1ccccc1)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N Show InChI InChI=1S/C19H26FN3OS/c1-19(2,25-10-6-9-14-7-4-3-5-8-14)17(22)18(24)23-13-15(20)11-16(23)12-21/h3-5,7-8,15-17H,6,9-11,13,22H2,1-2H3/t15-,16-,17+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 24 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173981
((2S,4S)-1-((R)-3-(4-methoxybenzylthio)-2-amino-3-m...)Show SMILES COc1ccc(CSC(C)(C)[C@H](N)C(=O)N2C[C@@H](F)C[C@H]2C#N)cc1 Show InChI InChI=1S/C18H24FN3O2S/c1-18(2,25-11-12-4-6-15(24-3)7-5-12)16(21)17(23)22-10-13(19)8-14(22)9-20/h4-7,13-14,16H,8,10-11,21H2,1-3H3/t13-,14-,16+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 29 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173958
((2S,4S)-1-((R)-2-amino-3-methyl-3-(pyridin-4-ylmet...)Show SMILES CC(C)(SCc1ccncc1)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N Show InChI InChI=1S/C16H21FN4OS/c1-16(2,23-10-11-3-5-20-6-4-11)14(19)15(22)21-9-12(17)7-13(21)8-18/h3-6,12-14H,7,9-10,19H2,1-2H3/t12-,13-,14+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 33 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173967
((2S,4S)-1-((R)-2-amino-3-((5-chlorobenzo[b]thiophe...)Show SMILES CC(C)([C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N)S(=O)(=O)Cc1csc2ccc(Cl)cc12 Show InChI InChI=1S/C19H21ClFN3O3S2/c1-19(2,17(23)18(25)24-8-13(21)6-14(24)7-22)29(26,27)10-11-9-28-16-4-3-12(20)5-15(11)16/h3-5,9,13-14,17H,6,8,10,23H2,1-2H3/t13-,14-,17+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173977
((2S,4S)-1-((R)-2-amino-3-(3-(4-fluorophenyl)propyl...)Show SMILES CC(C)(SCCCc1ccc(F)cc1)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N Show InChI InChI=1S/C19H25F2N3OS/c1-19(2,26-9-3-4-13-5-7-14(20)8-6-13)17(23)18(25)24-12-15(21)10-16(24)11-22/h5-8,15-17H,3-4,9-10,12,23H2,1-2H3/t15-,16-,17+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 45 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173971
(CHEMBL427193 | N-(((R)-3-amino-4-((2S,4S)-2-cyano-...)Show SMILES CC(=O)NCSC(C)(C)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N Show InChI InChI=1S/C13H21FN4O2S/c1-8(19)17-7-21-13(2,3)11(16)12(20)18-6-9(14)4-10(18)5-15/h9-11H,4,6-7,16H2,1-3H3,(H,17,19)/t9-,10-,11+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 46 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173963
((2S,4S)-1-((R)-2-amino-3-(4-methoxybenzylsulfonyl)...)Show SMILES COc1ccc(CS(=O)(=O)C(C)(C)[C@H](N)C(=O)N2C[C@@H](F)C[C@H]2C#N)cc1 |r| Show InChI InChI=1S/C18H24FN3O4S/c1-18(2,16(21)17(23)22-10-13(19)8-14(22)9-20)27(24,25)11-12-4-6-15(26-3)7-5-12/h4-7,13-14,16H,8,10-11,21H2,1-3H3/t13-,14-,16+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 53 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173979
((2S,4S)-1-((R)-2-amino-3-methyl-3-(phenethylthio)b...)Show SMILES CC(C)(SCCc1ccccc1)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N Show InChI InChI=1S/C18H24FN3OS/c1-18(2,24-9-8-13-6-4-3-5-7-13)16(21)17(23)22-12-14(19)10-15(22)11-20/h3-7,14-16H,8-10,12,21H2,1-2H3/t14-,15-,16+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 56 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173972
((2S,4S)-1-((R)-3-(4-(trifluoromethyl)benzylthio)-2...)Show SMILES CC(C)(SCc1ccc(cc1)C(F)(F)F)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N Show InChI InChI=1S/C18H21F4N3OS/c1-17(2,15(24)16(26)25-9-13(19)7-14(25)8-23)27-10-11-3-5-12(6-4-11)18(20,21)22/h3-6,13-15H,7,9-10,24H2,1-2H3/t13-,14-,15+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 63 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173961
((2S,4S)-1-((R)-3-(3-phenoxybenzylthio)-2-amino-3-m...)Show SMILES CC(C)(SCc1cccc(Oc2ccccc2)c1)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N Show InChI InChI=1S/C23H26FN3O2S/c1-23(2,21(26)22(28)27-14-17(24)12-18(27)13-25)30-15-16-7-6-10-20(11-16)29-19-8-4-3-5-9-19/h3-11,17-18,21H,12,14-15,26H2,1-2H3/t17-,18-,21+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 65 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173978
((2S,4S)-1-((R)-3-(4-cyanobenzylsulfonyl)-2-amino-3...)Show SMILES CC(C)([C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N)S(=O)(=O)Cc1ccc(cc1)C#N Show InChI InChI=1S/C18H21FN4O3S/c1-18(2,16(22)17(24)23-10-14(19)7-15(23)9-21)27(25,26)11-13-5-3-12(8-20)4-6-13/h3-6,14-16H,7,10-11,22H2,1-2H3/t14-,15-,16+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 68 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173965
((2S,4S)-1-((R)-3-(4-(methylsulfonyl)benzylsulfonyl...)Show SMILES CC(C)([C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N)S(=O)(=O)Cc1ccc(cc1)S(C)(=O)=O Show InChI InChI=1S/C18H24FN3O5S2/c1-18(2,16(21)17(23)22-10-13(19)8-14(22)9-20)29(26,27)11-12-4-6-15(7-5-12)28(3,24)25/h4-7,13-14,16H,8,10-11,21H2,1-3H3/t13-,14-,16+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 76 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173957
((2S,4S)-1-((R)-3-(4-methoxybenzylsulfinyl)-2-amino...)Show SMILES COc1ccc(CS(=O)C(C)(C)[C@H](N)C(=O)N2C[C@@H](F)C[C@H]2C#N)cc1 Show InChI InChI=1S/C18H24FN3O3S/c1-18(2,26(24)11-12-4-6-15(25-3)7-5-12)16(21)17(23)22-10-13(19)8-14(22)9-20/h4-7,13-14,16H,8,10-11,21H2,1-3H3/t13-,14-,16+,26?/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 112 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173959
((S)-1-((R)-3-(4-methoxybenzylsulfonyl)-2-amino-3-m...)Show SMILES COc1ccc(CS(=O)(=O)C(C)(C)[C@H](N)C(=O)N2CCC[C@H]2C#N)cc1 Show InChI InChI=1S/C18H25N3O4S/c1-18(2,16(20)17(22)21-10-4-5-14(21)11-19)26(23,24)12-13-6-8-15(25-3)9-7-13/h6-9,14,16H,4-5,10,12,20H2,1-3H3/t14-,16+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 115 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173968
((R)-3-amino-4-((2S,4S)-2-cyano-4-fluoropyrrolidin-...)Show SMILES CC(C)([C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N)S(O)(=O)=O Show InChI InChI=1S/C10H16FN3O4S/c1-10(2,19(16,17)18)8(13)9(15)14-5-6(11)3-7(14)4-12/h6-8H,3,5,13H2,1-2H3,(H,16,17,18)/t6-,7-,8+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| 154 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173973
(CHEMBL201053 | N-(4-(((R)-3-amino-4-((2S,4S)-2-cya...)Show SMILES CC(=O)Nc1ccc(CS(=O)(=O)C(C)(C)[C@H](N)C(=O)N2C[C@@H](F)C[C@H]2C#N)cc1 Show InChI InChI=1S/C19H25FN4O4S/c1-12(25)23-15-6-4-13(5-7-15)11-29(27,28)19(2,3)17(22)18(26)24-10-14(20)8-16(24)9-21/h4-7,14,16-17H,8,10-11,22H2,1-3H3,(H,23,25)/t14-,16-,17+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 225 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173964
((2S,4S)-1-((R)-3-(4-fluorobenzylsulfonyl)-2-amino-...)Show SMILES CC(C)([C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N)S(=O)(=O)Cc1ccc(F)cc1 Show InChI InChI=1S/C17H21F2N3O3S/c1-17(2,26(24,25)10-11-3-5-12(18)6-4-11)15(21)16(23)22-9-13(19)7-14(22)8-20/h3-6,13-15H,7,9-10,21H2,1-2H3/t13-,14-,15+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 281 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173962
((2S,4S)-1-((R)-2-amino-3-methyl-3-(3-phenylpropyls...)Show SMILES CC(C)([C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N)S(=O)(=O)CCCc1ccccc1 Show InChI InChI=1S/C19H26FN3O3S/c1-19(2,17(22)18(24)23-13-15(20)11-16(23)12-21)27(25,26)10-6-9-14-7-4-3-5-8-14/h3-5,7-8,15-17H,6,9-11,13,22H2,1-2H3/t15-,16-,17+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 302 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173975
((2S,4S)-1-((R)-3-(2-methoxybenzylsulfonyl)-2-amino...)Show SMILES COc1ccccc1CS(=O)(=O)C(C)(C)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N Show InChI InChI=1S/C18H24FN3O4S/c1-18(2,16(21)17(23)22-10-13(19)8-14(22)9-20)27(24,25)11-12-6-4-5-7-15(12)26-3/h4-7,13-14,16H,8,10-11,21H2,1-3H3/t13-,14-,16+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 309 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173984
((2S,4S)-1-((R)-3-(3-phenoxybenzylsulfonyl)-2-amino...)Show SMILES CC(C)([C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N)S(=O)(=O)Cc1cccc(Oc2ccccc2)c1 Show InChI InChI=1S/C23H26FN3O4S/c1-23(2,21(26)22(28)27-14-17(24)12-18(27)13-25)32(29,30)15-16-7-6-10-20(11-16)31-19-8-4-3-5-9-19/h3-11,17-18,21H,12,14-15,26H2,1-2H3/t17-,18-,21+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 310 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173970
((2S,4S)-1-((R)-3-(3-methoxybenzylsulfonyl)-2-amino...)Show SMILES COc1cccc(CS(=O)(=O)C(C)(C)[C@H](N)C(=O)N2C[C@@H](F)C[C@H]2C#N)c1 Show InChI InChI=1S/C18H24FN3O4S/c1-18(2,16(21)17(23)22-10-13(19)8-14(22)9-20)27(24,25)11-12-5-4-6-15(7-12)26-3/h4-7,13-14,16H,8,10-11,21H2,1-3H3/t13-,14-,16+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 316 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173966
((2S,4S)-1-((R)-2-amino-3-(benzylsulfonyl)-3-methyl...)Show SMILES CC(C)([C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N)S(=O)(=O)Cc1ccccc1 Show InChI InChI=1S/C17H22FN3O3S/c1-17(2,25(23,24)11-12-6-4-3-5-7-12)15(20)16(22)21-10-13(18)8-14(21)9-19/h3-7,13-15H,8,10-11,20H2,1-2H3/t13-,14-,15+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 324 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173969
((2S,4S)-1-((R)-3-(4-(benzyloxy)benzylsulfonyl)-2-a...)Show SMILES CC(C)([C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N)S(=O)(=O)Cc1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C24H28FN3O4S/c1-24(2,22(27)23(29)28-14-19(25)12-20(28)13-26)33(30,31)16-18-8-10-21(11-9-18)32-15-17-6-4-3-5-7-17/h3-11,19-20,22H,12,14-16,27H2,1-2H3/t19-,20-,22+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 428 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 2
(Homo sapiens (Human)) | BDBM50173983
((2S,4S)-1-((R)-2-amino-3-methyl-3-(3-phenylpropylt...)Show SMILES CC(C)(SCCCc1ccccc1)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N Show InChI InChI=1S/C19H26FN3OS/c1-19(2,25-10-6-9-14-7-4-3-5-8-14)17(22)18(24)23-13-15(20)11-16(23)12-21/h3-5,7-8,15-17H,6,9-11,13,22H2,1-2H3/t15-,16-,17+/m0/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 523 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant DPP2 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173974
((2S,4S)-1-((R)-2-amino-3-methyl-3-p-tolylmethanesu...)Show SMILES Cc1ccc(CS(=O)(=O)C(C)(C)[C@H](N)C(=O)N2C[C@@H](F)C[C@H]2C#N)cc1 Show InChI InChI=1S/C18H24FN3O3S/c1-12-4-6-13(7-5-12)11-26(24,25)18(2,3)16(21)17(23)22-10-14(19)8-15(22)9-20/h4-7,14-16H,8,10-11,21H2,1-3H3/t14-,15-,16+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 530 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173980
((2S,4S)-1-[(R)-2-amino-3-(biphenyl-4-ylmethanesulf...)Show SMILES CC(C)([C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N)S(=O)(=O)Cc1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C23H26FN3O3S/c1-23(2,21(26)22(28)27-14-19(24)12-20(27)13-25)31(29,30)15-16-8-10-18(11-9-16)17-6-4-3-5-7-17/h3-11,19-21H,12,14-15,26H2,1-2H3/t19-,20-,21+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 579 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 2
(Homo sapiens (Human)) | BDBM50173977
((2S,4S)-1-((R)-2-amino-3-(3-(4-fluorophenyl)propyl...)Show SMILES CC(C)(SCCCc1ccc(F)cc1)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N Show InChI InChI=1S/C19H25F2N3OS/c1-19(2,26-9-3-4-13-5-7-14(20)8-6-13)17(23)18(25)24-12-15(21)10-16(24)11-22/h5-8,15-17H,3-4,9-10,12,23H2,1-2H3/t15-,16-,17+/m0/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 701 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant DPP2 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 2
(Homo sapiens (Human)) | BDBM50173961
((2S,4S)-1-((R)-3-(3-phenoxybenzylthio)-2-amino-3-m...)Show SMILES CC(C)(SCc1cccc(Oc2ccccc2)c1)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N Show InChI InChI=1S/C23H26FN3O2S/c1-23(2,21(26)22(28)27-14-17(24)12-18(27)13-25)30-15-16-7-6-10-20(11-16)29-19-8-4-3-5-9-19/h3-11,17-18,21H,12,14-15,26H2,1-2H3/t17-,18-,21+/m0/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.07E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant DPP2 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 2
(Homo sapiens (Human)) | BDBM50173972
((2S,4S)-1-((R)-3-(4-(trifluoromethyl)benzylthio)-2...)Show SMILES CC(C)(SCc1ccc(cc1)C(F)(F)F)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N Show InChI InChI=1S/C18H21F4N3OS/c1-17(2,15(24)16(26)25-9-13(19)7-14(25)8-23)27-10-11-3-5-12(6-4-11)18(20,21)22/h3-6,13-15H,7,9-10,24H2,1-2H3/t13-,14-,15+/m0/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 1.13E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant DPP2 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Prolyl endopeptidase FAP
(Homo sapiens (Human)) | BDBM50173971
(CHEMBL427193 | N-(((R)-3-amino-4-((2S,4S)-2-cyano-...)Show SMILES CC(=O)NCSC(C)(C)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N Show InChI InChI=1S/C13H21FN4O2S/c1-8(19)17-7-21-13(2,3)11(16)12(20)18-6-9(14)4-10(18)5-15/h9-11H,4,6-7,16H2,1-3H3,(H,17,19)/t9-,10-,11+/m0/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 1.28E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant seprase |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50173982
((2S,4S)-1-((R)-2-amino-3-methyl-3-(pyridin-4-ylmet...)Show SMILES CC(C)([C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N)S(=O)(=O)Cc1ccncc1 Show InChI InChI=1S/C16H21FN4O3S/c1-16(2,25(23,24)10-11-3-5-20-6-4-11)14(19)15(22)21-9-12(17)7-13(21)8-18/h3-6,12-14H,7,9-10,19H2,1-2H3/t12-,13-,14+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.28E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against human DPP4 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 2
(Homo sapiens (Human)) | BDBM50173981
((2S,4S)-1-((R)-3-(4-methoxybenzylthio)-2-amino-3-m...)Show SMILES COc1ccc(CSC(C)(C)[C@H](N)C(=O)N2C[C@@H](F)C[C@H]2C#N)cc1 Show InChI InChI=1S/C18H24FN3O2S/c1-18(2,25-11-12-4-6-15(24-3)7-5-12)16(21)17(23)22-10-13(19)8-14(22)9-20/h4-7,13-14,16H,8,10-11,21H2,1-3H3/t13-,14-,16+/m0/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 3.95E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant DPP2 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Prolyl endopeptidase FAP
(Homo sapiens (Human)) | BDBM50173967
((2S,4S)-1-((R)-2-amino-3-((5-chlorobenzo[b]thiophe...)Show SMILES CC(C)([C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N)S(=O)(=O)Cc1csc2ccc(Cl)cc12 Show InChI InChI=1S/C19H21ClFN3O3S2/c1-19(2,17(23)18(25)24-8-13(21)6-14(24)7-22)29(26,27)10-11-9-28-16-4-3-12(20)5-15(11)16/h3-5,9,13-14,17H,6,8,10,23H2,1-2H3/t13-,14-,17+/m0/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 5.16E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant seprase |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Prolyl endopeptidase FAP
(Homo sapiens (Human)) | BDBM50173984
((2S,4S)-1-((R)-3-(3-phenoxybenzylsulfonyl)-2-amino...)Show SMILES CC(C)([C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N)S(=O)(=O)Cc1cccc(Oc2ccccc2)c1 Show InChI InChI=1S/C23H26FN3O4S/c1-23(2,21(26)22(28)27-14-17(24)12-18(27)13-25)32(29,30)15-16-7-6-10-20(11-16)31-19-8-4-3-5-9-19/h3-11,17-18,21H,12,14-15,26H2,1-2H3/t17-,18-,21+/m0/s1 | PDB
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| 6.86E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant seprase |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Prolyl endopeptidase FAP
(Homo sapiens (Human)) | BDBM50173973
(CHEMBL201053 | N-(4-(((R)-3-amino-4-((2S,4S)-2-cya...)Show SMILES CC(=O)Nc1ccc(CS(=O)(=O)C(C)(C)[C@H](N)C(=O)N2C[C@@H](F)C[C@H]2C#N)cc1 Show InChI InChI=1S/C19H25FN4O4S/c1-12(25)23-15-6-4-13(5-7-15)11-29(27,28)19(2,3)17(22)18(26)24-10-14(20)8-16(24)9-21/h4-7,14,16-17H,8,10-11,22H2,1-3H3,(H,23,25)/t14-,16-,17+/m0/s1 | PDB
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| 7.93E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant seprase |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Prolyl endopeptidase FAP
(Homo sapiens (Human)) | BDBM50173978
((2S,4S)-1-((R)-3-(4-cyanobenzylsulfonyl)-2-amino-3...)Show SMILES CC(C)([C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N)S(=O)(=O)Cc1ccc(cc1)C#N Show InChI InChI=1S/C18H21FN4O3S/c1-18(2,16(22)17(24)23-10-14(19)7-15(23)9-21)27(25,26)11-13-5-3-12(8-20)4-6-13/h3-6,14-16H,7,10-11,22H2,1-2H3/t14-,15-,16+/m0/s1 | PDB
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| 9.45E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant seprase |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Prolyl endopeptidase FAP
(Homo sapiens (Human)) | BDBM50173980
((2S,4S)-1-[(R)-2-amino-3-(biphenyl-4-ylmethanesulf...)Show SMILES CC(C)([C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N)S(=O)(=O)Cc1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C23H26FN3O3S/c1-23(2,21(26)22(28)27-14-19(24)12-20(27)13-25)31(29,30)15-16-8-10-18(11-9-16)17-6-4-3-5-7-17/h3-11,19-21H,12,14-15,26H2,1-2H3/t19-,20-,21+/m0/s1 | PDB
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| 9.66E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant seprase |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Prolyl endopeptidase FAP
(Homo sapiens (Human)) | BDBM50173958
((2S,4S)-1-((R)-2-amino-3-methyl-3-(pyridin-4-ylmet...)Show SMILES CC(C)(SCc1ccncc1)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N Show InChI InChI=1S/C16H21FN4OS/c1-16(2,23-10-11-3-5-20-6-4-11)14(19)15(22)21-9-12(17)7-13(21)8-18/h3-6,12-14H,7,9-10,19H2,1-2H3/t12-,13-,14+/m0/s1 | PDB
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| 9.66E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant seprase |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Prolyl endopeptidase FAP
(Homo sapiens (Human)) | BDBM50173983
((2S,4S)-1-((R)-2-amino-3-methyl-3-(3-phenylpropylt...)Show SMILES CC(C)(SCCCc1ccccc1)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N Show InChI InChI=1S/C19H26FN3OS/c1-19(2,25-10-6-9-14-7-4-3-5-8-14)17(22)18(24)23-13-15(20)11-16(23)12-21/h3-5,7-8,15-17H,6,9-11,13,22H2,1-2H3/t15-,16-,17+/m0/s1 | PDB
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| 1.22E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant seprase |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Prolyl endopeptidase FAP
(Homo sapiens (Human)) | BDBM50173975
((2S,4S)-1-((R)-3-(2-methoxybenzylsulfonyl)-2-amino...)Show SMILES COc1ccccc1CS(=O)(=O)C(C)(C)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N Show InChI InChI=1S/C18H24FN3O4S/c1-18(2,16(21)17(23)22-10-13(19)8-14(22)9-20)27(24,25)11-12-6-4-5-7-15(12)26-3/h4-7,13-14,16H,8,10-11,21H2,1-3H3/t13-,14-,16+/m0/s1 | PDB
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| 1.24E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant seprase |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Prolyl endopeptidase FAP
(Homo sapiens (Human)) | BDBM50173961
((2S,4S)-1-((R)-3-(3-phenoxybenzylthio)-2-amino-3-m...)Show SMILES CC(C)(SCc1cccc(Oc2ccccc2)c1)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N Show InChI InChI=1S/C23H26FN3O2S/c1-23(2,21(26)22(28)27-14-17(24)12-18(27)13-25)30-15-16-7-6-10-20(11-16)29-19-8-4-3-5-9-19/h3-11,17-18,21H,12,14-15,26H2,1-2H3/t17-,18-,21+/m0/s1 | PDB
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| 1.28E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant seprase |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 2
(Homo sapiens (Human)) | BDBM50173979
((2S,4S)-1-((R)-2-amino-3-methyl-3-(phenethylthio)b...)Show SMILES CC(C)(SCCc1ccccc1)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N Show InChI InChI=1S/C18H24FN3OS/c1-18(2,24-9-8-13-6-4-3-5-7-13)16(21)17(23)22-12-14(19)10-15(22)11-20/h3-7,14-16H,8-10,12,21H2,1-2H3/t14-,15-,16+/m0/s1 | PDB
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| 1.44E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant DPP2 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Prolyl endopeptidase FAP
(Homo sapiens (Human)) | BDBM50173968
((R)-3-amino-4-((2S,4S)-2-cyano-4-fluoropyrrolidin-...)Show SMILES CC(C)([C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N)S(O)(=O)=O Show InChI InChI=1S/C10H16FN3O4S/c1-10(2,19(16,17)18)8(13)9(15)14-5-6(11)3-7(14)4-12/h6-8H,3,5,13H2,1-2H3,(H,16,17,18)/t6-,7-,8+/m0/s1 | PDB
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| 1.46E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant seprase |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Prolyl endopeptidase FAP
(Homo sapiens (Human)) | BDBM50173977
((2S,4S)-1-((R)-2-amino-3-(3-(4-fluorophenyl)propyl...)Show SMILES CC(C)(SCCCc1ccc(F)cc1)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N Show InChI InChI=1S/C19H25F2N3OS/c1-19(2,26-9-3-4-13-5-7-14(20)8-6-13)17(23)18(25)24-12-15(21)10-16(24)11-22/h5-8,15-17H,3-4,9-10,12,23H2,1-2H3/t15-,16-,17+/m0/s1 | PDB
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| 1.58E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant seprase |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Prolyl endopeptidase FAP
(Homo sapiens (Human)) | BDBM50173970
((2S,4S)-1-((R)-3-(3-methoxybenzylsulfonyl)-2-amino...)Show SMILES COc1cccc(CS(=O)(=O)C(C)(C)[C@H](N)C(=O)N2C[C@@H](F)C[C@H]2C#N)c1 Show InChI InChI=1S/C18H24FN3O4S/c1-18(2,16(21)17(23)22-10-13(19)8-14(22)9-20)27(24,25)11-12-5-4-6-15(7-12)26-3/h4-7,13-14,16H,8,10-11,21H2,1-3H3/t13-,14-,16+/m0/s1 | PDB
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| 1.70E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant seprase |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Dipeptidyl peptidase 2
(Homo sapiens (Human)) | BDBM50173965
((2S,4S)-1-((R)-3-(4-(methylsulfonyl)benzylsulfonyl...)Show SMILES CC(C)([C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N)S(=O)(=O)Cc1ccc(cc1)S(C)(=O)=O Show InChI InChI=1S/C18H24FN3O5S2/c1-18(2,16(21)17(23)22-10-13(19)8-14(22)9-20)29(26,27)11-12-4-6-15(7-5-12)28(3,24)25/h4-7,13-14,16H,8,10-11,21H2,1-3H3/t13-,14-,16+/m0/s1 | PDB
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| 1.73E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant DPP2 |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Prolyl endopeptidase FAP
(Homo sapiens (Human)) | BDBM50173960
((2S,4S)-1-((R)-2-amino-3-methyl-3-(pyridin-2-ylmet...)Show SMILES CC(C)(SCc1ccccn1)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N Show InChI InChI=1S/C16H21FN4OS/c1-16(2,23-10-12-5-3-4-6-20-12)14(19)15(22)21-9-11(17)7-13(21)8-18/h3-6,11,13-14H,7,9-10,19H2,1-2H3/t11-,13-,14+/m0/s1 | PDB
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| 1.91E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant seprase |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
Prolyl endopeptidase FAP
(Homo sapiens (Human)) | BDBM50173969
((2S,4S)-1-((R)-3-(4-(benzyloxy)benzylsulfonyl)-2-a...)Show SMILES CC(C)([C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N)S(=O)(=O)Cc1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C24H28FN3O4S/c1-24(2,22(27)23(29)28-14-19(25)12-20(28)13-26)33(30,31)16-18-8-10-21(11-9-18)32-15-17-6-4-3-5-7-17/h3-11,19-20,22H,12,14-16,27H2,1-2H3/t19-,20-,22+/m0/s1 | PDB
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| 2.04E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Research and Development
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant seprase |
Bioorg Med Chem Lett 15: 5257-61 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.050
BindingDB Entry DOI: 10.7270/Q21R6Q2C |
More data for this
Ligand-Target Pair | |
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