Found 27 hits with Last Name = 'perumattam' and Initial = 'jj' 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 |
|---|
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50306491
(2-(6-chloro-5-((2R,5S)-4-(1-(4-fluorophenyl)ethyl)...)Show SMILES CC(N1C[C@@H](C)N(C[C@@H]1C)C(=O)c1cc2c(cn(C)c2cc1Cl)C(=O)C(=O)N(C)C)c1ccc(F)cc1 |r| Show InChI InChI=1S/C28H32ClFN4O3/c1-16-14-34(17(2)13-33(16)18(3)19-7-9-20(30)10-8-19)27(36)22-11-21-23(26(35)28(37)31(4)5)15-32(6)25(21)12-24(22)29/h7-12,15-18H,13-14H2,1-6H3/t16-,17+,18?/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios inc
Curated by ChEMBL
| Assay Description
Inhibition of p38alpha |
Bioorg Med Chem Lett 20: 828-31 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.091
BindingDB Entry DOI: 10.7270/Q22N52CF |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50266947
(2-(6-chloro-5-((2R,5S)-4-(4-fluorobenzyl)-2,5-dime...)Show SMILES C[C@H]1CN([C@H](C)CN1Cc1ccc(F)cc1)C(=O)c1cc2c(cn(C)c2cc1Cl)C(=O)C(=O)N(C)C |r| Show InChI InChI=1S/C27H30ClFN4O3/c1-16-13-33(17(2)12-32(16)14-18-6-8-19(29)9-7-18)26(35)21-10-20-22(25(34)27(36)30(3)4)15-31(5)24(20)11-23(21)28/h6-11,15-17H,12-14H2,1-5H3/t16-,17+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PDB
Article
PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios inc
Curated by ChEMBL
| Assay Description
Inhibition of p38alpha |
Bioorg Med Chem Lett 20: 828-31 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.091
BindingDB Entry DOI: 10.7270/Q22N52CF |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50306493
(2-(5-((2R,5S)-4-benzhydryl-2,5-dimethylpiperazine-...)Show SMILES C[C@H]1CN([C@H](C)CN1C(c1ccccc1)c1ccccc1)C(=O)c1cc2c(cn(C)c2cc1Cl)C(=O)C(=O)N(C)C |r| Show InChI InChI=1S/C33H35ClN4O3/c1-21-19-38(22(2)18-37(21)30(23-12-8-6-9-13-23)24-14-10-7-11-15-24)32(40)26-16-25-27(31(39)33(41)35(3)4)20-36(5)29(25)17-28(26)34/h6-17,20-22,30H,18-19H2,1-5H3/t21-,22+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios inc
Curated by ChEMBL
| Assay Description
Inhibition of p38alpha |
Bioorg Med Chem Lett 20: 828-31 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.091
BindingDB Entry DOI: 10.7270/Q22N52CF |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50309525
(2-(5-(4-(4-fluorobenzyl)piperidine-1-carbonyl)-6-m...)Show SMILES COc1cc2[nH]cc(C(=O)C(=O)N(C)C)c2cc1C(=O)N1CCC(Cc2ccc(F)cc2)CC1 Show InChI InChI=1S/C26H28FN3O4/c1-29(2)26(33)24(31)21-15-28-22-14-23(34-3)20(13-19(21)22)25(32)30-10-8-17(9-11-30)12-16-4-6-18(27)7-5-16/h4-7,13-15,17,28H,8-12H2,1-3H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios, Inc
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha after 60 mins |
Bioorg Med Chem Lett 20: 1059-62 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.031
BindingDB Entry DOI: 10.7270/Q2J38SP4 |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50309524
(2-(6-chloro-5-(4-(4-fluorobenzyl)piperidine-1-carb...)Show SMILES CN(C)C(=O)C(=O)c1c[nH]c2cc(Cl)c(cc12)C(=O)N1CCC(Cc2ccc(F)cc2)CC1 Show InChI InChI=1S/C25H25ClFN3O3/c1-29(2)25(33)23(31)20-14-28-22-13-21(26)19(12-18(20)22)24(32)30-9-7-16(8-10-30)11-15-3-5-17(27)6-4-15/h3-6,12-14,16,28H,7-11H2,1-2H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| n/a | n/a | 18 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios, Inc
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha after 60 mins |
Bioorg Med Chem Lett 20: 1059-62 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.031
BindingDB Entry DOI: 10.7270/Q2J38SP4 |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50132378
(((1S,3R)-4-Benzyl-2,5-dimethyl-piperazin-1-yl)-(6-...)Show SMILES COc1cc2[nH]ccc2cc1C(=O)N1C[C@H](C)N(Cc2ccccc2)C[C@H]1C |r| Show InChI InChI=1S/C23H27N3O2/c1-16-14-26(17(2)13-25(16)15-18-7-5-4-6-8-18)23(27)20-11-19-9-10-24-21(19)12-22(20)28-3/h4-12,16-17,24H,13-15H2,1-3H3/t16-,17+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Mitogen-activated protein kinase p38 alpha |
Bioorg Med Chem Lett 13: 3087-90 (2003)
BindingDB Entry DOI: 10.7270/Q2S181XN |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50132378
(((1S,3R)-4-Benzyl-2,5-dimethyl-piperazin-1-yl)-(6-...)Show SMILES COc1cc2[nH]ccc2cc1C(=O)N1C[C@H](C)N(Cc2ccccc2)C[C@H]1C |r| Show InChI InChI=1S/C23H27N3O2/c1-16-14-26(17(2)13-25(16)15-18-7-5-4-6-8-18)23(27)20-11-19-9-10-24-21(19)12-22(20)28-3/h4-12,16-17,24H,13-15H2,1-3H3/t16-,17+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Mitogen-activated protein kinase p38 alpha |
Bioorg Med Chem Lett 13: 3087-90 (2003)
BindingDB Entry DOI: 10.7270/Q2S181XN |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50306492
(2-(5-((2R,5S)-4-(bis(4-fluorophenyl)methyl)-2,5-di...)Show SMILES C[C@H]1CN([C@H](C)CN1C(c1ccc(F)cc1)c1ccc(F)cc1)C(=O)c1cc2c(cn(C)c2cc1Cl)C(=O)C(=O)N(C)C |r| Show InChI InChI=1S/C33H33ClF2N4O3/c1-19-17-40(20(2)16-39(19)30(21-6-10-23(35)11-7-21)22-8-12-24(36)13-9-22)32(42)26-14-25-27(31(41)33(43)37(3)4)18-38(5)29(25)15-28(26)34/h6-15,18-20,30H,16-17H2,1-5H3/t19-,20+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 24 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios inc
Curated by ChEMBL
| Assay Description
Inhibition of p38alpha |
Bioorg Med Chem Lett 20: 828-31 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.091
BindingDB Entry DOI: 10.7270/Q22N52CF |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50306494
(2-(6-chloro-5-((2R,5S)-4-(2,3-dihydro-1H-inden-1-y...)Show SMILES C[C@H]1CN([C@H](C)CN1C1CCc2ccccc12)C(=O)c1cc2c(cn(C)c2cc1Cl)C(=O)C(=O)N(C)C |r| Show InChI InChI=1S/C29H33ClN4O3/c1-17-15-34(18(2)14-33(17)25-11-10-19-8-6-7-9-20(19)25)28(36)22-12-21-23(27(35)29(37)31(3)4)16-32(5)26(21)13-24(22)30/h6-9,12-13,16-18,25H,10-11,14-15H2,1-5H3/t17-,18+,25?/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 29 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios inc
Curated by ChEMBL
| Assay Description
Inhibition of p38alpha |
Bioorg Med Chem Lett 20: 828-31 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.091
BindingDB Entry DOI: 10.7270/Q22N52CF |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50306496
(2-(6-chloro-5-((2R,5S)-4-(1-cyano-1-(4-fluoropheny...)Show SMILES C[C@@H]1CN([C@@H](C)CN1C(=O)c1cc2c(cn(C)c2cc1Cl)C(=O)C(=O)N(C)C)C(C)(C#N)c1ccc(F)cc1 |r| Show InChI InChI=1S/C29H31ClFN5O3/c1-17-14-36(29(3,16-32)19-7-9-20(31)10-8-19)18(2)13-35(17)27(38)22-11-21-23(26(37)28(39)33(4)5)15-34(6)25(21)12-24(22)30/h7-12,15,17-18H,13-14H2,1-6H3/t17-,18+,29?/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 47 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios inc
Curated by ChEMBL
| Assay Description
Inhibition of p38alpha |
Bioorg Med Chem Lett 20: 828-31 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.091
BindingDB Entry DOI: 10.7270/Q22N52CF |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50306497
(2-(6-chloro-5-((2R,5S)-4-(7-chloro-1H-indazol-3-yl...)Show SMILES C[C@@H]1CN([C@@H](C)CN1C(=O)c1cc2c(cn(C)c2cc1Cl)C(=O)C(=O)N(C)C)c1n[nH]c2c(Cl)cccc12 |r| Show InChI InChI=1S/C27H28Cl2N6O3/c1-14-12-35(15(2)11-34(14)25-16-7-6-8-20(28)23(16)30-31-25)26(37)18-9-17-19(24(36)27(38)32(3)4)13-33(5)22(17)10-21(18)29/h6-10,13-15H,11-12H2,1-5H3,(H,30,31)/t14-,15+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 48 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios inc
Curated by ChEMBL
| Assay Description
Inhibition of p38alpha |
Bioorg Med Chem Lett 20: 828-31 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.091
BindingDB Entry DOI: 10.7270/Q22N52CF |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50309531
(2-(5-(4-(4-fluorobenzyl)piperidine-1-carbonyl)-6-m...)Show SMILES COc1nc2[nH]cc(C(=O)C(=O)N(C)C)c2cc1C(=O)N1CCC(Cc2ccc(F)cc2)CC1 Show InChI InChI=1S/C25H27FN4O4/c1-29(2)25(33)21(31)20-14-27-22-18(20)13-19(23(28-22)34-3)24(32)30-10-8-16(9-11-30)12-15-4-6-17(26)7-5-15/h4-7,13-14,16H,8-12H2,1-3H3,(H,27,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| n/a | n/a | 60 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios, Inc
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha after 60 mins |
Bioorg Med Chem Lett 20: 1059-62 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.031
BindingDB Entry DOI: 10.7270/Q2J38SP4 |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50309529
(2-(3-(4-(4-fluorobenzyl)piperidine-1-carbonyl)-2-m...)Show SMILES CN(C)C(=O)C(=O)c1ccc2[nH]c(C)c(C(=O)N3CCC(Cc4ccc(F)cc4)CC3)c2c1 Show InChI InChI=1S/C26H28FN3O3/c1-16-23(21-15-19(6-9-22(21)28-16)24(31)26(33)29(2)3)25(32)30-12-10-18(11-13-30)14-17-4-7-20(27)8-5-17/h4-9,15,18,28H,10-14H2,1-3H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| n/a | n/a | 90 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios, Inc
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha after 60 mins |
Bioorg Med Chem Lett 20: 1059-62 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.031
BindingDB Entry DOI: 10.7270/Q2J38SP4 |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 11
(Homo sapiens (Human)) | BDBM50266947
(2-(6-chloro-5-((2R,5S)-4-(4-fluorobenzyl)-2,5-dime...)Show SMILES C[C@H]1CN([C@H](C)CN1Cc1ccc(F)cc1)C(=O)c1cc2c(cn(C)c2cc1Cl)C(=O)C(=O)N(C)C |r| Show InChI InChI=1S/C27H30ClFN4O3/c1-16-13-33(17(2)12-32(16)14-18-6-8-19(29)9-7-18)26(35)21-10-20-22(25(34)27(36)30(3)4)15-31(5)24(20)11-23(21)28/h6-11,15-17H,12-14H2,1-5H3/t16-,17+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 98 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios inc
Curated by ChEMBL
| Assay Description
Inhibition of p38beta |
Bioorg Med Chem Lett 20: 828-31 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.091
BindingDB Entry DOI: 10.7270/Q22N52CF |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50309528
(2-(6-chloro-5-(4-(4-fluorobenzyl)piperidine-1-carb...)Show SMILES CN(C)C(=O)C(=O)c1nn(C)c2cc(Cl)c(cc12)C(=O)N1CCC(Cc2ccc(F)cc2)CC1 Show InChI InChI=1S/C25H26ClFN4O3/c1-29(2)25(34)23(32)22-19-13-18(20(26)14-21(19)30(3)28-22)24(33)31-10-8-16(9-11-31)12-15-4-6-17(27)7-5-15/h4-7,13-14,16H,8-12H2,1-3H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios, Inc
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha after 60 mins |
Bioorg Med Chem Lett 20: 1059-62 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.031
BindingDB Entry DOI: 10.7270/Q2J38SP4 |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50306495
(2-(6-chloro-5-((2R,5S)-4-(cyano(4-fluorophenyl)met...)Show SMILES C[C@H]1CN([C@H](C)CN1C(C#N)c1ccc(F)cc1)C(=O)c1cc2c(cn(C)c2cc1Cl)C(=O)C(=O)N(C)C |r| Show InChI InChI=1S/C28H29ClFN5O3/c1-16-14-35(17(2)13-34(16)25(12-31)18-6-8-19(30)9-7-18)27(37)21-10-20-22(26(36)28(38)32(3)4)15-33(5)24(20)11-23(21)29/h6-11,15-17,25H,13-14H2,1-5H3/t16-,17+,25?/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 183 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios inc
Curated by ChEMBL
| Assay Description
Inhibition of p38alpha |
Bioorg Med Chem Lett 20: 828-31 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.091
BindingDB Entry DOI: 10.7270/Q22N52CF |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50309530
(2-(5-(4-(4-fluorobenzyl)piperidine-1-carbonyl)-6-m...)Show SMILES COc1cc2occ(C(=O)C(=O)N(C)C)c2cc1C(=O)N1CCC(Cc2ccc(F)cc2)CC1 Show InChI InChI=1S/C26H27FN2O5/c1-28(2)26(32)24(30)21-15-34-23-14-22(33-3)20(13-19(21)23)25(31)29-10-8-17(9-11-29)12-16-4-6-18(27)7-5-16/h4-7,13-15,17H,8-12H2,1-3H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 600 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios, Inc
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha after 60 mins |
Bioorg Med Chem Lett 20: 1059-62 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.031
BindingDB Entry DOI: 10.7270/Q2J38SP4 |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50309526
(2-(3-(4-(4-fluorobenzyl)piperidine-1-carbonyl)-4-m...)Show SMILES COc1ccc(cc1C(=O)N1CCC(Cc2ccc(F)cc2)CC1)C(=O)C(=O)N(C)C Show InChI InChI=1S/C24H27FN2O4/c1-26(2)24(30)22(28)18-6-9-21(31-3)20(15-18)23(29)27-12-10-17(11-13-27)14-16-4-7-19(25)8-5-16/h4-9,15,17H,10-14H2,1-3H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| n/a | n/a | 945 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios, Inc
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha after 60 mins |
Bioorg Med Chem Lett 20: 1059-62 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.031
BindingDB Entry DOI: 10.7270/Q2J38SP4 |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50132375
((4-Benzyl-piperazin-1-yl)-(6-methoxy-1H-indol-5-yl...)Show InChI InChI=1S/C21H23N3O2/c1-26-20-14-19-17(7-8-22-19)13-18(20)21(25)24-11-9-23(10-12-24)15-16-5-3-2-4-6-16/h2-8,13-14,22H,9-12,15H2,1H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 950 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Mitogen-activated protein kinase p38 alpha |
Bioorg Med Chem Lett 13: 3087-90 (2003)
BindingDB Entry DOI: 10.7270/Q2S181XN |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50132381
(((1S,3R)-4-Benzyl-2,5-dimethyl-piperazin-1-yl)-(1H...)Show SMILES C[C@H]1CN([C@H](C)CN1Cc1ccccc1)C(=O)c1ccc2[nH]ccc2c1 Show InChI InChI=1S/C22H25N3O/c1-16-14-25(17(2)13-24(16)15-18-6-4-3-5-7-18)22(26)20-8-9-21-19(12-20)10-11-23-21/h3-12,16-17,23H,13-15H2,1-2H3/t16-,17+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Mitogen-activated protein kinase p38 alpha |
Bioorg Med Chem Lett 13: 3087-90 (2003)
BindingDB Entry DOI: 10.7270/Q2S181XN |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50132377
((4-Benzyl-piperazin-1-yl)-(1H-indol-4-yl)-methanon...)Show InChI InChI=1S/C20H21N3O/c24-20(18-7-4-8-19-17(18)9-10-21-19)23-13-11-22(12-14-23)15-16-5-2-1-3-6-16/h1-10,21H,11-15H2 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.54E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Mitogen-activated protein kinase p38 alpha |
Bioorg Med Chem Lett 13: 3087-90 (2003)
BindingDB Entry DOI: 10.7270/Q2S181XN |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50132376
(((1R,3S)-4-Benzyl-2,5-dimethyl-piperazin-1-yl)-(6-...)Show SMILES COc1cc2[nH]ccc2cc1C(=O)N1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C Show InChI InChI=1S/C23H27N3O2/c1-16-14-26(17(2)13-25(16)15-18-7-5-4-6-8-18)23(27)20-11-19-9-10-24-21(19)12-22(20)28-3/h4-12,16-17,24H,13-15H2,1-3H3/t16-,17+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.65E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Mitogen-activated protein kinase p38 alpha |
Bioorg Med Chem Lett 13: 3087-90 (2003)
BindingDB Entry DOI: 10.7270/Q2S181XN |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50132379
((4-Benzyl-piperazin-1-yl)-(1H-indol-5-yl)-methanon...)Show InChI InChI=1S/C20H21N3O/c24-20(18-6-7-19-17(14-18)8-9-21-19)23-12-10-22(11-13-23)15-16-4-2-1-3-5-16/h1-9,14,21H,10-13,15H2 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 4.36E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Mitogen-activated protein kinase p38 alpha |
Bioorg Med Chem Lett 13: 3087-90 (2003)
BindingDB Entry DOI: 10.7270/Q2S181XN |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50132382
((4-Benzyl-piperazin-1-yl)-(1H-indol-3-yl)-methanon...)Show InChI InChI=1S/C20H21N3O/c24-20(18-14-21-19-9-5-4-8-17(18)19)23-12-10-22(11-13-23)15-16-6-2-1-3-7-16/h1-9,14,21H,10-13,15H2 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 4.74E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Mitogen-activated protein kinase p38 alpha |
Bioorg Med Chem Lett 13: 3087-90 (2003)
BindingDB Entry DOI: 10.7270/Q2S181XN |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50132374
((4-Benzyl-piperazin-1-yl)-(1H-indol-6-yl)-methanon...)Show InChI InChI=1S/C20H21N3O/c24-20(18-7-6-17-8-9-21-19(17)14-18)23-12-10-22(11-13-23)15-16-4-2-1-3-5-16/h1-9,14,21H,10-13,15H2 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 5.52E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Mitogen-activated protein kinase p38 alpha |
Bioorg Med Chem Lett 13: 3087-90 (2003)
BindingDB Entry DOI: 10.7270/Q2S181XN |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50309527
(2-(3-(4-(4-fluorobenzyl)piperidine-1-carbonyl)-2-(...)Show SMILES CN(C)C(=O)C(=O)c1ccc2OC(C(=Cc2c1)C(=O)N1CCC(Cc2ccc(F)cc2)CC1)C(F)(F)F |c:13| Show InChI InChI=1S/C27H26F4N2O4/c1-32(2)26(36)23(34)18-5-8-22-19(14-18)15-21(24(37-22)27(29,30)31)25(35)33-11-9-17(10-12-33)13-16-3-6-20(28)7-4-16/h3-8,14-15,17,24H,9-13H2,1-2H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios, Inc
Curated by ChEMBL
| Assay Description
Inhibition of human p38alpha after 60 mins |
Bioorg Med Chem Lett 20: 1059-62 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.031
BindingDB Entry DOI: 10.7270/Q2J38SP4 |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50132380
((4-Benzyl-piperazin-1-yl)-(1H-indol-7-yl)-methanon...)Show InChI InChI=1S/C20H21N3O/c24-20(18-8-4-7-17-9-10-21-19(17)18)23-13-11-22(12-14-23)15-16-5-2-1-3-6-16/h1-10,21H,11-15H2 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Scios Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Mitogen-activated protein kinase p38 alpha |
Bioorg Med Chem Lett 13: 3087-90 (2003)
BindingDB Entry DOI: 10.7270/Q2S181XN |
More data for this
Ligand-Target Pair | |
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