Found 187 hits with Last Name = 'srinivasan' and Initial = 'v' 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 |
|---|
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052789
(CHEMBL3318616)Show SMILES O=C(N1CCN(Cc2ccc(Oc3ccccc3)cc2)CC1)n1cc(cn1)C#N Show InChI InChI=1S/C22H21N5O2/c23-14-19-15-24-27(17-19)22(28)26-12-10-25(11-13-26)16-18-6-8-21(9-7-18)29-20-4-2-1-3-5-20/h1-9,15,17H,10-13,16H2 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 0.100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Irreversible inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052783
(CHEMBL3318605)Show InChI InChI=1S/C20H19N5O/c21-12-17-13-22-25(15-17)20(26)24-9-7-23(8-10-24)14-16-5-6-18-3-1-2-4-19(18)11-16/h1-6,11,13,15H,7-10,14H2 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 0.160 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Irreversible inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052768
(CHEMBL3318613)Show SMILES O=C(N1CCN(Cc2ccc(OCc3ccccc3)cc2)CC1)n1cc(cn1)C#N Show InChI InChI=1S/C23H23N5O2/c24-14-21-15-25-28(17-21)23(29)27-12-10-26(11-13-27)16-19-6-8-22(9-7-19)30-18-20-4-2-1-3-5-20/h1-9,15,17H,10-13,16,18H2 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 0.160 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052771
(CHEMBL3318617)Show SMILES O=C(N1CCN(Cc2ccc(cc2)-c2ccccc2)CC1)n1cc(cn1)C#N Show InChI InChI=1S/C22H21N5O/c23-14-19-15-24-27(17-19)22(28)26-12-10-25(11-13-26)16-18-6-8-21(9-7-18)20-4-2-1-3-5-20/h1-9,15,17H,10-13,16H2 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 0.190 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052785
(CHEMBL3318607)Show InChI InChI=1S/C19H19IN4O/c20-18-12-21-24(14-18)19(25)23-9-7-22(8-10-23)13-15-5-6-16-3-1-2-4-17(16)11-15/h1-6,11-12,14H,7-10,13H2 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.290 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Irreversible inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052786
(CHEMBL3318610)Show SMILES COC(=O)c1cnn(c1)C(=O)N1CCN(Cc2ccc3ccccc3c2)CC1 Show InChI InChI=1S/C21H22N4O3/c1-28-20(26)19-13-22-25(15-19)21(27)24-10-8-23(9-11-24)14-16-6-7-17-4-2-3-5-18(17)12-16/h2-7,12-13,15H,8-11,14H2,1H3 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 0.360 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Irreversible inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052784
(CHEMBL3318606)Show InChI InChI=1S/C19H19BrN4O/c20-18-12-21-24(14-18)19(25)23-9-7-22(8-10-23)13-15-5-6-16-3-1-2-4-17(16)11-15/h1-6,11-12,14H,7-10,13H2 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.470 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Irreversible inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052787
(CHEMBL3318614)Show InChI InChI=1S/C21H22N4O2/c26-21(25-12-4-11-22-25)24-15-13-23(14-16-24)17-18-7-9-20(10-8-18)27-19-5-2-1-3-6-19/h1-12H,13-17H2 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 9.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Irreversible inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052781
(CHEMBL3318603)Show InChI InChI=1S/C19H20N4O/c24-19(23-9-3-8-20-23)22-12-10-21(11-13-22)15-16-6-7-17-4-1-2-5-18(17)14-16/h1-9,14H,10-13,15H2 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 9.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Irreversible inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052766
(CHEMBL3318611)Show SMILES O=C(N1CCN(Cc2ccc(OCc3ccccc3)cc2)CC1)n1cccn1 Show InChI InChI=1S/C22H24N4O2/c27-22(26-12-4-11-23-26)25-15-13-24(14-16-25)17-19-7-9-21(10-8-19)28-18-20-5-2-1-3-6-20/h1-12H,13-18H2 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052769
(CHEMBL3318608)Show InChI InChI=1S/C21H22N4O/c26-21(25-12-4-11-22-25)24-15-13-23(14-16-24)17-18-7-9-20(10-8-18)19-5-2-1-3-6-19/h1-12H,13-17H2 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50326165
(CHEMBL1241315 | oxalylaminobenzoic acid)Show SMILES CCc1cc(C[C@H]2NC(=O)CN(CCCCOc3cccc(O)c3C(=O)OC)C2=O)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O |r| Show InChI InChI=1S/C34H35N3O11/c1-3-21-17-20(13-14-24(21)37(31(41)33(44)45)25-10-5-4-9-22(25)32(42)43)18-23-30(40)36(19-28(39)35-23)15-6-7-16-48-27-12-8-11-26(38)29(27)34(46)47-2/h4-5,8-14,17,23,38H,3,6-7,15-16,18-19H2,1-2H3,(H,35,39)(H,42,43)(H,44,45)/t23-/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
| 18 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant PTP1B after 30 mins by spectrophotometry |
Eur J Med Chem 45: 3709-18 (2010)
Article DOI: 10.1016/j.ejmech.2010.05.020
BindingDB Entry DOI: 10.7270/Q24Q7V6S |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM13976
(Aminobenzoic acid analog 5 | CHEMBL116605)Show SMILES CCc1cc(CC(NC(C)=O)C(=O)NCCCCOc2cccc(O)c2C(=O)OC)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O Show InChI InChI=1S/C34H37N3O11/c1-4-22-18-21(14-15-25(22)37(31(41)33(44)45)26-11-6-5-10-23(26)32(42)43)19-24(36-20(2)38)30(40)35-16-7-8-17-48-28-13-9-12-27(39)29(28)34(46)47-3/h5-6,9-15,18,24,39H,4,7-8,16-17,19H2,1-3H3,(H,35,40)(H,36,38)(H,42,43)(H,44,45) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 18 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description
Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009
BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052774
(CHEMBL3318620)Show InChI InChI=1S/C15H16N4O/c16-10-14-11-18-19(12-14)15(20)17-9-5-4-8-13-6-2-1-3-7-13/h1-3,6-7,11-12H,4-5,8-9H2,(H,17,20) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 42 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052762
(CHEMBL3318593)Show InChI InChI=1S/C14H19N5O3/c1-14(2,3)22-13(21)18-6-4-17(5-7-18)12(20)19-10-11(8-15)9-16-19/h9-10H,4-7H2,1-3H3 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 55 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM13976
(Aminobenzoic acid analog 5 | CHEMBL116605)Show SMILES CCc1cc(CC(NC(C)=O)C(=O)NCCCCOc2cccc(O)c2C(=O)OC)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O Show InChI InChI=1S/C34H37N3O11/c1-4-22-18-21(14-15-25(22)37(31(41)33(44)45)26-11-6-5-10-23(26)32(42)43)19-24(36-20(2)38)30(40)35-16-7-8-17-48-28-13-9-12-27(39)29(28)34(46)47-3/h5-6,9-15,18,24,39H,4,7-8,16-17,19H2,1-3H3,(H,35,40)(H,36,38)(H,42,43)(H,44,45) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
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 |
Glenmark Research Center
Curated by ChEMBL
| Assay Description
Inhibition of TCPTP |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009
BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM50326165
(CHEMBL1241315 | oxalylaminobenzoic acid)Show SMILES CCc1cc(C[C@H]2NC(=O)CN(CCCCOc3cccc(O)c3C(=O)OC)C2=O)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O |r| Show InChI InChI=1S/C34H35N3O11/c1-3-21-17-20(13-14-24(21)37(31(41)33(44)45)25-10-5-4-9-22(25)32(42)43)18-23-30(40)36(19-28(39)35-23)15-6-7-16-48-27-12-8-11-26(38)29(27)34(46)47-2/h4-5,8-14,17,23,38H,3,6-7,15-16,18-19H2,1-2H3,(H,35,39)(H,42,43)(H,44,45)/t23-/m1/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
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 |
Glenmark Research Center
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant TCPTP after 30 mins by spectrophotometry |
Eur J Med Chem 45: 3709-18 (2010)
Article DOI: 10.1016/j.ejmech.2010.05.020
BindingDB Entry DOI: 10.7270/Q24Q7V6S |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052765
(CHEMBL3318602)Show InChI InChI=1S/C16H17N5O/c17-10-15-11-18-21(13-15)16(22)20-8-6-19(7-9-20)12-14-4-2-1-3-5-14/h1-5,11,13H,6-9,12H2 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 75 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052760
(CHEMBL3318590)Show InChI InChI=1S/C10H12N4O/c11-6-9-7-12-14(8-9)10(15)13-4-2-1-3-5-13/h7-8H,1-5H2 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052767
(CHEMBL3318612)Show SMILES Cc1cnn(c1)C(=O)N1CCN(Cc2ccc(OCc3ccccc3)cc2)CC1 Show InChI InChI=1S/C23H26N4O2/c1-19-15-24-27(16-19)23(28)26-13-11-25(12-14-26)17-20-7-9-22(10-8-20)29-18-21-5-3-2-4-6-21/h2-10,15-16H,11-14,17-18H2,1H3 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052782
(CHEMBL3318604)Show InChI InChI=1S/C20H22N4O/c1-16-13-21-24(14-16)20(25)23-10-8-22(9-11-23)15-17-6-7-18-4-2-3-5-19(18)12-17/h2-7,12-14H,8-11,15H2,1H3 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Irreversible inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052770
(CHEMBL3318609)Show SMILES Cc1cnn(c1)C(=O)N1CCN(Cc2ccc(cc2)-c2ccccc2)CC1 Show InChI InChI=1S/C22H24N4O/c1-18-15-23-26(16-18)22(27)25-13-11-24(12-14-25)17-19-7-9-21(10-8-19)20-5-3-2-4-6-20/h2-10,15-16H,11-14,17H2,1H3 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 170 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052763
(CHEMBL3318600)Show InChI InChI=1S/C15H18N4O/c20-15(19-8-4-7-16-19)18-11-9-17(10-12-18)13-14-5-2-1-3-6-14/h1-8H,9-13H2 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 180 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052777
(CHEMBL3318623)Show InChI InChI=1S/C15H15N3O2/c16-10-14-11-17-18(12-14)15(19)20-9-5-4-8-13-6-2-1-3-7-13/h1-3,6-7,11-12H,4-5,8-9H2 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 210 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052788
(CHEMBL3318615)Show SMILES Cc1cnn(c1)C(=O)N1CCN(Cc2ccc(Oc3ccccc3)cc2)CC1 Show InChI InChI=1S/C22H24N4O2/c1-18-15-23-26(16-18)22(27)25-13-11-24(12-14-25)17-19-7-9-21(10-8-19)28-20-5-3-2-4-6-20/h2-10,15-16H,11-14,17H2,1H3 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 210 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Irreversible inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052764
(CHEMBL3318601)Show InChI InChI=1S/C16H20N4O/c1-14-11-17-20(12-14)16(21)19-9-7-18(8-10-19)13-15-5-3-2-4-6-15/h2-6,11-12H,7-10,13H2,1H3 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 250 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052772
(CHEMBL3318618)Show InChI InChI=1S/C14H17N3O/c18-14(17-12-6-11-16-17)15-10-5-4-9-13-7-2-1-3-8-13/h1-3,6-8,11-12H,4-5,9-10H2,(H,15,18) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 290 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052731
(CHEMBL3318591)Show InChI InChI=1S/C13H20N4O3/c1-13(2,3)20-12(19)16-9-7-15(8-10-16)11(18)17-6-4-5-14-17/h4-6H,7-10H2,1-3H3 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 340 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052773
(CHEMBL3318619)Show InChI InChI=1S/C15H19N3O/c1-13-11-17-18(12-13)15(19)16-10-6-5-9-14-7-3-2-4-8-14/h2-4,7-8,11-12H,5-6,9-10H2,1H3,(H,16,19) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 550 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052775
(CHEMBL3318621)Show InChI InChI=1S/C14H16N2O2/c17-14(16-11-6-10-15-16)18-12-5-4-9-13-7-2-1-3-8-13/h1-3,6-8,10-11H,4-5,9,12H2 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 710 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052791
(CHEMBL3318588)Show InChI InChI=1S/C9H13N3O/c13-9(12-8-4-5-10-12)11-6-2-1-3-7-11/h4-5,8H,1-3,6-7H2 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 750 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052761
(CHEMBL3318592)Show InChI InChI=1S/C14H22N4O3/c1-11-9-15-18(10-11)12(19)16-5-7-17(8-6-16)13(20)21-14(2,3)4/h9-10H,5-8H2,1-4H3 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 850 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052790
(CHEMBL3318589)Show InChI InChI=1S/C10H15N3O/c1-9-7-11-13(8-9)10(14)12-5-3-2-4-6-12/h7-8H,2-6H2,1H3 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296368
(7-(biphenyl-4-yl)-4-oxo-4H-chromene-3-carbaldehyde...)Show InChI InChI=1S/C22H14O3/c23-13-19-14-25-21-12-18(10-11-20(21)22(19)24)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h1-14H | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant PTP1B after 30 mins by spectrophotometry |
Eur J Med Chem 45: 3709-18 (2010)
Article DOI: 10.1016/j.ejmech.2010.05.020
BindingDB Entry DOI: 10.7270/Q24Q7V6S |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM50296368
(7-(biphenyl-4-yl)-4-oxo-4H-chromene-3-carbaldehyde...)Show InChI InChI=1S/C22H14O3/c23-13-19-14-25-21-12-18(10-11-20(21)22(19)24)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h1-14H | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description
Inhibition of TCPTP |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009
BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052780
(CHEMBL3318626)Show InChI InChI=1S/C16H17N3O/c17-11-15-12-18-19(13-15)16(20)10-6-2-5-9-14-7-3-1-4-8-14/h1,3-4,7-8,12-13H,2,5-6,9-10H2 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052776
(CHEMBL3318622)Show InChI InChI=1S/C15H18N2O2/c1-13-11-16-17(12-13)15(18)19-10-6-5-9-14-7-3-2-4-8-14/h2-4,7-8,11-12H,5-6,9-10H2,1H3 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052779
(CHEMBL3318625)Show InChI InChI=1S/C16H20N2O/c1-14-12-17-18(13-14)16(19)11-7-3-6-10-15-8-4-2-5-9-15/h2,4-5,8-9,12-13H,3,6-7,10-11H2,1H3 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 [30-579]
(Rattus norvegicus (rat)) | BDBM50052778
(CHEMBL3318624)Show InChI InChI=1S/C15H18N2O/c18-15(17-13-7-12-16-17)11-6-2-5-10-14-8-3-1-4-9-14/h1,3-4,7-9,12-13H,2,5-6,10-11H2 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant rat FAAH preincubated for 3 hrs |
Bioorg Med Chem Lett 24: 3807-13 (2014)
Article DOI: 10.1016/j.bmcl.2014.06.063
BindingDB Entry DOI: 10.7270/Q2VM4DWQ |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50133280
(5-(3-(3-(3-hydroxy-2-(methoxycarbonyl)phenoxy)prop...)Show SMILES COC(=O)c1c(O)cccc1OC\C=C\c1cccc(c1)-c1cc(no1)C(O)=O Show InChI InChI=1S/C21H17NO7/c1-27-21(26)19-16(23)8-3-9-17(19)28-10-4-6-13-5-2-7-14(11-13)18-12-15(20(24)25)22-29-18/h2-9,11-12,23H,10H2,1H3,(H,24,25)/b6-4+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description
Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009
BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this
Ligand-Target Pair | 
3D Structure (docked) |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50133280
(5-(3-(3-(3-hydroxy-2-(methoxycarbonyl)phenoxy)prop...)Show SMILES COC(=O)c1c(O)cccc1OC\C=C\c1cccc(c1)-c1cc(no1)C(O)=O Show InChI InChI=1S/C21H17NO7/c1-27-21(26)19-16(23)8-3-9-17(19)28-10-4-6-13-5-2-7-14(11-13)18-12-15(20(24)25)22-29-18/h2-9,11-12,23H,10H2,1H3,(H,24,25)/b6-4+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant PTP1B after 30 mins by spectrophotometry |
Eur J Med Chem 45: 3709-18 (2010)
Article DOI: 10.1016/j.ejmech.2010.05.020
BindingDB Entry DOI: 10.7270/Q24Q7V6S |
More data for this
Ligand-Target Pair |
3D Structure (docked) |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296368
(7-(biphenyl-4-yl)-4-oxo-4H-chromene-3-carbaldehyde...)Show InChI InChI=1S/C22H14O3/c23-13-19-14-25-21-12-18(10-11-20(21)22(19)24)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h1-14H | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description
Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009
BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM50296368
(7-(biphenyl-4-yl)-4-oxo-4H-chromene-3-carbaldehyde...)Show InChI InChI=1S/C22H14O3/c23-13-19-14-25-21-12-18(10-11-20(21)22(19)24)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h1-14H | PDB
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant TCPTP after 30 mins by spectrophotometry |
Eur J Med Chem 45: 3709-18 (2010)
Article DOI: 10.1016/j.ejmech.2010.05.020
BindingDB Entry DOI: 10.7270/Q24Q7V6S |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM50133280
(5-(3-(3-(3-hydroxy-2-(methoxycarbonyl)phenoxy)prop...)Show SMILES COC(=O)c1c(O)cccc1OC\C=C\c1cccc(c1)-c1cc(no1)C(O)=O Show InChI InChI=1S/C21H17NO7/c1-27-21(26)19-16(23)8-3-9-17(19)28-10-4-6-13-5-2-7-14(11-13)18-12-15(20(24)25)22-29-18/h2-9,11-12,23H,10H2,1H3,(H,24,25)/b6-4+ | PDB
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| CHEMBL
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PC sid
UniChem
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PubMed
| 2.02E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description
Inhibition of TCPTP |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009
BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM50133280
(5-(3-(3-(3-hydroxy-2-(methoxycarbonyl)phenoxy)prop...)Show SMILES COC(=O)c1c(O)cccc1OC\C=C\c1cccc(c1)-c1cc(no1)C(O)=O Show InChI InChI=1S/C21H17NO7/c1-27-21(26)19-16(23)8-3-9-17(19)28-10-4-6-13-5-2-7-14(11-13)18-12-15(20(24)25)22-29-18/h2-9,11-12,23H,10H2,1H3,(H,24,25)/b6-4+ | PDB
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| CHEMBL
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Similars
| Article
PubMed
| 2.02E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant TCPTP after 30 mins by spectrophotometry |
Eur J Med Chem 45: 3709-18 (2010)
Article DOI: 10.1016/j.ejmech.2010.05.020
BindingDB Entry DOI: 10.7270/Q24Q7V6S |
More data for this
Ligand-Target Pair | |
cAMP-specific 3',5'-cyclic phosphodiesterase 4B
(Homo sapiens (Human)) | BDBM14774
(3-(cyclopropylmethoxy)-N-(3,5-dichloropyridin-4-yl...)Show SMILES FC(F)Oc1ccc(cc1OCC1CC1)C(=O)Nc1c(Cl)cncc1Cl Show InChI InChI=1S/C17H14Cl2F2N2O3/c18-11-6-22-7-12(19)15(11)23-16(24)10-3-4-13(26-17(20)21)14(5-10)25-8-9-1-2-9/h3-7,9,17H,1-2,8H2,(H,22,23,24) | PDB
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| PDB
Article
PubMed
| n/a | n/a | 0.200 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of human PDE4B using [3H]cAMP as substrate incubated for 5 mins followed by substrate addition and measured after 10 mins by scintillation... |
Citation and Details
Article DOI: 10.1016/j.bmc.2016.09.011
BindingDB Entry DOI: 10.7270/Q2N58R28 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
cAMP-specific 3',5'-cyclic phosphodiesterase 4B
(Homo sapiens (Human)) | BDBM50558593
(CHEMBL4747406)Show SMILES Cc1sc(nc1C(=O)NC1CCC(O)CC1)-c1ccc(OC(F)F)c2oc3ccc(NS(C)(=O)=O)cc3c12 |(50.66,-6.46,;51.56,-7.7,;51.09,-9.17,;52.35,-10.07,;53.59,-9.16,;53.11,-7.69,;54.01,-6.45,;53.38,-5.04,;55.54,-6.61,;56.44,-5.36,;55.81,-3.96,;56.72,-2.71,;58.25,-2.87,;59.15,-1.62,;58.87,-4.27,;57.97,-5.52,;52.36,-11.61,;51.02,-12.39,;51.02,-13.94,;52.36,-14.71,;52.37,-16.26,;51.04,-17.03,;51.04,-18.57,;49.7,-16.26,;53.69,-13.93,;55.17,-14.41,;56.08,-13.15,;57.61,-12.99,;58.23,-11.58,;57.32,-10.33,;57.94,-8.92,;59.46,-8.75,;60.08,-7.35,;60.95,-9.15,;59.86,-10.24,;55.79,-10.5,;55.17,-11.91,;53.69,-12.38,)| | PDB
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antibodypedia
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| PC cid
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| n/a | n/a | 25 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of human PDE4B using [3H]cAMP as substrate incubated for 5 mins followed by substrate addition and measured after 10 mins by scintillation... |
Citation and Details
Article DOI: 10.1016/j.bmc.2016.09.011
BindingDB Entry DOI: 10.7270/Q2N58R28 |
More data for this
Ligand-Target Pair | |
cAMP-specific 3',5'-cyclic phosphodiesterase 4B
(Homo sapiens (Human)) | BDBM50558594
(CHEMBL4744412)Show SMILES CS(=O)(=O)Nc1ccc2oc3c(OC(F)F)ccc(-c4nc(cs4)C(=O)NC4CCC(O)CC4)c3c2c1 |(15.21,-7.74,;14.59,-9.14,;16.07,-9.54,;14.98,-10.62,;13.06,-9.31,;12.44,-10.72,;13.35,-11.96,;12.73,-13.37,;11.2,-13.54,;10.29,-14.79,;8.82,-14.32,;7.49,-15.1,;7.49,-16.64,;6.16,-17.41,;6.16,-18.95,;4.83,-16.65,;6.15,-14.33,;6.15,-12.78,;7.48,-12,;7.47,-10.46,;8.71,-9.55,;8.23,-8.08,;6.69,-8.09,;6.22,-9.56,;9.14,-6.84,;8.51,-5.43,;10.67,-6.99,;11.57,-5.75,;10.94,-4.34,;11.84,-3.1,;13.37,-3.25,;14.27,-2.01,;14,-4.66,;13.1,-5.9,;8.82,-12.77,;10.29,-12.29,;10.91,-10.89,)| | PDB
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| PC cid
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| n/a | n/a | 31 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of human PDE4B using [3H]cAMP as substrate incubated for 5 mins followed by substrate addition and measured after 10 mins by scintillation... |
Citation and Details
Article DOI: 10.1016/j.bmc.2016.09.011
BindingDB Entry DOI: 10.7270/Q2N58R28 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50326165
(CHEMBL1241315 | oxalylaminobenzoic acid)Show SMILES CCc1cc(C[C@H]2NC(=O)CN(CCCCOc3cccc(O)c3C(=O)OC)C2=O)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O |r| Show InChI InChI=1S/C34H35N3O11/c1-3-21-17-20(13-14-24(21)37(31(41)33(44)45)25-10-5-4-9-22(25)32(42)43)18-23-30(40)36(19-28(39)35-23)15-6-7-16-48-27-12-8-11-26(38)29(27)34(46)47-2/h4-5,8-14,17,23,38H,3,6-7,15-16,18-19H2,1-2H3,(H,35,39)(H,42,43)(H,44,45)/t23-/m1/s1 | PDB
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Reactome pathway
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PubMed
| n/a | n/a | 38 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant PTP1B after 30 mins by spectrophotometry |
Eur J Med Chem 45: 3709-18 (2010)
Article DOI: 10.1016/j.ejmech.2010.05.020
BindingDB Entry DOI: 10.7270/Q24Q7V6S |
More data for this
Ligand-Target Pair | |
cAMP-specific 3',5'-cyclic phosphodiesterase 4B
(Homo sapiens (Human)) | BDBM50558595
(CHEMBL4764245)Show SMILES CC(=O)Nc1ccc2oc3c(OC(F)F)ccc(-c4nc(cs4)C(=O)NC4CCC(O)CC4)c3c2c1 |(67.92,-47.27,;67.3,-48.68,;68.21,-49.92,;65.78,-48.84,;65.16,-50.25,;66.07,-51.5,;65.45,-52.91,;63.91,-53.07,;63,-54.33,;61.53,-53.85,;60.2,-54.63,;60.2,-56.17,;58.87,-56.95,;58.88,-58.49,;57.54,-56.18,;58.86,-53.86,;58.86,-52.31,;60.2,-51.53,;60.19,-49.99,;61.43,-49.08,;60.95,-47.61,;59.4,-47.62,;58.93,-49.09,;61.85,-46.37,;61.22,-44.96,;63.38,-46.53,;64.28,-45.28,;63.65,-43.88,;64.55,-42.63,;66.08,-42.79,;66.99,-41.54,;66.71,-44.19,;65.81,-45.44,;61.53,-52.3,;63,-51.83,;63.63,-50.42,)| | PDB
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| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of human PDE4B using [3H]cAMP as substrate incubated for 5 mins followed by substrate addition and measured after 10 mins by scintillation... |
Citation and Details
Article DOI: 10.1016/j.bmc.2016.09.011
BindingDB Entry DOI: 10.7270/Q2N58R28 |
More data for this
Ligand-Target Pair | |
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