Found 142 hits with Last Name = 'mcclellan' and Initial = 'ga' 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 |
|---|
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194976
((S)-2-((6-(2-(5-methyl-2-phenyloxazol-4-yl)ethoxy)...)Show SMILES Cc1oc(nc1CCOc1ccc(C[C@@]2(CCCO2)C(O)=O)cn1)-c1ccccc1 Show InChI InChI=1S/C23H24N2O5/c1-16-19(25-21(30-16)18-6-3-2-4-7-18)10-13-28-20-9-8-17(15-24-20)14-23(22(26)27)11-5-12-29-23/h2-4,6-9,15H,5,10-14H2,1H3,(H,26,27)/t23-/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
| 6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194957
(2-((6-(2-(2-(3-methoxyphenyl)-5-methyloxazol-4-yl)...)Show SMILES COc1cccc(c1)-c1nc(CCOc2ccc(CC3(CCCO3)C(O)=O)cn2)c(C)o1 Show InChI InChI=1S/C24H26N2O6/c1-16-20(26-22(32-16)18-5-3-6-19(13-18)29-2)9-12-30-21-8-7-17(15-25-21)14-24(23(27)28)10-4-11-31-24/h3,5-8,13,15H,4,9-12,14H2,1-2H3,(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
Similars
| Article
PubMed
| 7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194955
(2-((6-(2-(2-(3-chlorophenyl)-5-methyloxazol-4-yl)e...)Show SMILES Cc1oc(nc1CCOc1ccc(CC2(CCCO2)C(O)=O)cn1)-c1cccc(Cl)c1 Show InChI InChI=1S/C23H23ClN2O5/c1-15-19(26-21(31-15)17-4-2-5-18(24)12-17)8-11-29-20-7-6-16(14-25-20)13-23(22(27)28)9-3-10-30-23/h2,4-7,12,14H,3,8-11,13H2,1H3,(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
Similars
| Article
PubMed
| 11 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194968
(3-(6-(4-(3-chlorophenoxy)-2-methylphenethoxy)pyrid...)Show SMILES COC(Cc1ccc(OCCc2ccc(Oc3cccc(Cl)c3)cc2C)nc1)C(O)=O Show InChI InChI=1S/C24H24ClNO5/c1-16-12-21(31-20-5-3-4-19(25)14-20)8-7-18(16)10-11-30-23-9-6-17(15-26-23)13-22(29-2)24(27)28/h3-9,12,14-15,22H,10-11,13H2,1-2H3,(H,27,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 15 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194971
(2-((6-(2-(5-methyl-2-(3-(trifluoromethyl)phenyl)ox...)Show SMILES Cc1oc(nc1CCOc1ccc(CC2(CCCO2)C(O)=O)cn1)-c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C24H23F3N2O5/c1-15-19(29-21(34-15)17-4-2-5-18(12-17)24(25,26)27)8-11-32-20-7-6-16(14-28-20)13-23(22(30)31)9-3-10-33-23/h2,4-7,12,14H,3,8-11,13H2,1H3,(H,30,31) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 15 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194961
(2-((6-(2-(5-methyl-2-m-tolyloxazol-4-yl)ethoxy)pyr...)Show SMILES Cc1oc(nc1CCOc1ccc(CC2(CCCO2)C(O)=O)cn1)-c1cccc(C)c1 Show InChI InChI=1S/C24H26N2O5/c1-16-5-3-6-19(13-16)22-26-20(17(2)31-22)9-12-29-21-8-7-18(15-25-21)14-24(23(27)28)10-4-11-30-24/h3,5-8,13,15H,4,9-12,14H2,1-2H3,(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
Similars
| Article
PubMed
| 16 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194950
(2-((6-(2-(2-(4-methoxyphenyl)-5-methyloxazol-4-yl)...)Show SMILES COc1ccc(cc1)-c1nc(CCOc2ccc(CC3(CCCO3)C(O)=O)cn2)c(C)o1 Show InChI InChI=1S/C24H26N2O6/c1-16-20(26-22(32-16)18-5-7-19(29-2)8-6-18)10-13-30-21-9-4-17(15-25-21)14-24(23(27)28)11-3-12-31-24/h4-9,15H,3,10-14H2,1-2H3,(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
Similars
| Article
PubMed
| 17 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194974
(2-((6-(2-(5-methyl-2-p-tolyloxazol-4-yl)ethoxy)pyr...)Show SMILES Cc1oc(nc1CCOc1ccc(CC2(CCCO2)C(O)=O)cn1)-c1ccc(C)cc1 Show InChI InChI=1S/C24H26N2O5/c1-16-4-7-19(8-5-16)22-26-20(17(2)31-22)10-13-29-21-9-6-18(15-25-21)14-24(23(27)28)11-3-12-30-24/h4-9,15H,3,10-14H2,1-2H3,(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
Similars
| Article
PubMed
| 23 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194967
(2-((6-(2-(5-methyl-2-phenyloxazol-4-yl)ethoxy)pyri...)Show SMILES Cc1oc(nc1CCOc1ccc(CC2(CCCO2)C(O)=O)cn1)-c1ccccc1 Show InChI InChI=1S/C23H24N2O5/c1-16-19(25-21(30-16)18-6-3-2-4-7-18)10-13-28-20-9-8-17(15-24-20)14-23(22(26)27)11-5-12-29-23/h2-4,6-9,15H,5,10-14H2,1H3,(H,26,27) | 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
| 38 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194969
(2-((6-(2-(2-(4-chlorophenyl)-5-methyloxazol-4-yl)e...)Show SMILES Cc1oc(nc1CCOc1ccc(CC2(CCCO2)C(O)=O)cn1)-c1ccc(Cl)cc1 Show InChI InChI=1S/C23H23ClN2O5/c1-15-19(26-21(31-15)17-4-6-18(24)7-5-17)9-12-29-20-8-3-16(14-25-20)13-23(22(27)28)10-2-11-30-23/h3-8,14H,2,9-13H2,1H3,(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
Similars
| Article
PubMed
| 52 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194963
(2-methoxy-3-(6-(2-(5-methyl-2-phenyloxazol-4-yl)et...)Show SMILES COC(Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)nc1)C(O)=O Show InChI InChI=1S/C21H22N2O5/c1-14-17(23-20(28-14)16-6-4-3-5-7-16)10-11-27-19-9-8-15(13-22-19)12-18(26-2)21(24)25/h3-9,13,18H,10-12H2,1-2H3,(H,24,25) | 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
| 63 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194952
(2-((6-(2-(5-methyl-2-phenyloxazol-4-yl)ethoxy)pyri...)Show SMILES Cc1oc(nc1CCOc1ccc(CC2(CCCCO2)C(O)=O)cn1)-c1ccccc1 Show InChI InChI=1S/C24H26N2O5/c1-17-20(26-22(31-17)19-7-3-2-4-8-19)11-14-29-21-10-9-18(16-25-21)15-24(23(27)28)12-5-6-13-30-24/h2-4,7-10,16H,5-6,11-15H2,1H3,(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
Similars
| Article
PubMed
| 81 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194970
(2-((6-(2-(5-methyl-2-(4-(trifluoromethyl)phenyl)ox...)Show SMILES Cc1oc(nc1CCOc1ccc(CC2(CCCO2)C(O)=O)cn1)-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C24H23F3N2O5/c1-15-19(29-21(34-15)17-4-6-18(7-5-17)24(25,26)27)9-12-32-20-8-3-16(14-28-20)13-23(22(30)31)10-2-11-33-23/h3-8,14H,2,9-13H2,1H3,(H,30,31) | 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
| 94 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194953
(2-ethoxy-3-(6-(2-(5-methyl-2-phenyloxazol-4-yl)eth...)Show SMILES CCOC(Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)nc1)C(O)=O Show InChI InChI=1S/C22H24N2O5/c1-3-27-19(22(25)26)13-16-9-10-20(23-14-16)28-12-11-18-15(2)29-21(24-18)17-7-5-4-6-8-17/h4-10,14,19H,3,11-13H2,1-2H3,(H,25,26) | 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
| 150 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194977
(2-((6-(2-(5-methyl-2-phenyloxazol-4-yl)ethoxy)pyri...)Show SMILES CCCC(Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)nc1)C(O)=O Show InChI InChI=1S/C23H26N2O4/c1-3-7-19(23(26)27)14-17-10-11-21(24-15-17)28-13-12-20-16(2)29-22(25-20)18-8-5-4-6-9-18/h4-6,8-11,15,19H,3,7,12-14H2,1-2H3,(H,26,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 240 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194965
((S)-2-methoxy-2-methyl-3-(6-(2-(5-methyl-2-phenylo...)Show SMILES CO[C@@](C)(Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)nc1)C(O)=O Show InChI InChI=1S/C22H24N2O5/c1-15-18(24-20(29-15)17-7-5-4-6-8-17)11-12-28-19-10-9-16(14-23-19)13-22(2,27-3)21(25)26/h4-10,14H,11-13H2,1-3H3,(H,25,26)/t22-/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
| 270 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194973
(2-((6-(2-(2-(4-cyanophenyl)-5-methyloxazol-4-yl)et...)Show SMILES Cc1oc(nc1CCOc1ccc(CC2(CCCO2)C(O)=O)cn1)-c1ccc(cc1)C#N Show InChI InChI=1S/C24H23N3O5/c1-16-20(27-22(32-16)19-6-3-17(14-25)4-7-19)9-12-30-21-8-5-18(15-26-21)13-24(23(28)29)10-2-11-31-24/h3-8,15H,2,9-13H2,1H3,(H,28,29) | 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
| 334 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194956
(4-methyl-2-((6-(2-(5-methyl-2-phenyloxazol-4-yl)et...)Show SMILES CC(C)CC(Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)nc1)C(O)=O Show InChI InChI=1S/C24H28N2O4/c1-16(2)13-20(24(27)28)14-18-9-10-22(25-15-18)29-12-11-21-17(3)30-23(26-21)19-7-5-4-6-8-19/h4-10,15-16,20H,11-14H2,1-3H3,(H,27,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 360 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194960
(1-((6-(2-(5-methyl-2-phenyloxazol-4-yl)ethoxy)pyri...)Show SMILES Cc1oc(nc1CCOc1ccc(CC2(CCC2)C(O)=O)cn1)-c1ccccc1 Show InChI InChI=1S/C23H24N2O4/c1-16-19(25-21(29-16)18-6-3-2-4-7-18)10-13-28-20-9-8-17(15-24-20)14-23(22(26)27)11-5-12-23/h2-4,6-9,15H,5,10-14H2,1H3,(H,26,27) | 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
| 394 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM28681
(5-[(4-{2-[methyl(pyridin-2-yl)amino]ethoxy}phenyl)...)Show InChI InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,22H,10-12H2,1H3,(H,20,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PDB
Article
PubMed
| 440 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194975
(2-methoxy-2-methyl-3-(6-(2-(5-methyl-2-phenyloxazo...)Show SMILES COC(C)(Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)nc1)C(O)=O Show InChI InChI=1S/C22H24N2O5/c1-15-18(24-20(29-15)17-7-5-4-6-8-17)11-12-28-19-10-9-16(14-23-19)13-22(2,27-3)21(25)26/h4-10,14H,11-13H2,1-3H3,(H,25,26) | 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
| 560 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194958
(2-((6-(3-(5-methyl-2-phenyloxazol-4-yl)propoxy)pyr...)Show SMILES Cc1oc(nc1CCCOc1ccc(CC2(CCCO2)C(O)=O)cn1)-c1ccccc1 Show InChI InChI=1S/C24H26N2O5/c1-17-20(26-22(31-17)19-7-3-2-4-8-19)9-5-13-29-21-11-10-18(16-25-21)15-24(23(27)28)12-6-14-30-24/h2-4,7-8,10-11,16H,5-6,9,12-15H2,1H3,(H,27,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 810 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194954
(2-((6-(2-(5-methyl-2-phenyloxazol-4-yl)ethoxy)pyri...)Show SMILES CCC(Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)nc1)C(O)=O Show InChI InChI=1S/C22H24N2O4/c1-3-17(22(25)26)13-16-9-10-20(23-14-16)27-12-11-19-15(2)28-21(24-19)18-7-5-4-6-8-18/h4-10,14,17H,3,11-13H2,1-2H3,(H,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194951
(2-methyl-3-(6-(2-(5-methyl-2-phenyloxazol-4-yl)eth...)Show SMILES CC(Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)nc1)C(O)=O Show InChI InChI=1S/C21H22N2O4/c1-14(21(24)25)12-16-8-9-19(22-13-16)26-11-10-18-15(2)27-20(23-18)17-6-4-3-5-7-17/h3-9,13-14H,10-12H2,1-2H3,(H,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194962
(1-((6-(2-(5-methyl-2-phenyloxazol-4-yl)ethoxy)pyri...)Show SMILES Cc1oc(nc1CCOc1ccc(CC2(CCCCC2)C(O)=O)cn1)-c1ccccc1 Show InChI InChI=1S/C25H28N2O4/c1-18-21(27-23(31-18)20-8-4-2-5-9-20)12-15-30-22-11-10-19(17-26-22)16-25(24(28)29)13-6-3-7-14-25/h2,4-5,8-11,17H,3,6-7,12-16H2,1H3,(H,28,29) | 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
| 3.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194959
(2,2-dimethyl-3-(6-(2-(5-methyl-2-phenyloxazol-4-yl...)Show SMILES Cc1oc(nc1CCOc1ccc(CC(C)(C)C(O)=O)cn1)-c1ccccc1 Show InChI InChI=1S/C22H24N2O4/c1-15-18(24-20(28-15)17-7-5-4-6-8-17)11-12-27-19-10-9-16(14-23-19)13-22(2,3)21(25)26/h4-10,14H,11-13H2,1-3H3,(H,25,26) | 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+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194972
(1-((6-(2-(5-methyl-2-phenyloxazol-4-yl)ethoxy)pyri...)Show SMILES Cc1oc(nc1CCOc1ccc(CC2(CC2)C(O)=O)cn1)-c1ccccc1 Show InChI InChI=1S/C22H22N2O4/c1-15-18(24-20(28-15)17-5-3-2-4-6-17)9-12-27-19-8-7-16(14-23-19)13-22(10-11-22)21(25)26/h2-8,14H,9-13H2,1H3,(H,25,26) | 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
| 7.98E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194966
(3-methyl-2-((6-(2-(5-methyl-2-phenyloxazol-4-yl)et...)Show SMILES CC(C)C(Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)nc1)C(O)=O Show InChI InChI=1S/C23H26N2O4/c1-15(2)19(23(26)27)13-17-9-10-21(24-14-17)28-12-11-20-16(3)29-22(25-20)18-7-5-4-6-8-18/h4-10,14-15,19H,11-13H2,1-3H3,(H,26,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 8.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194979
(3,3-dimethyl-2-((6-(2-(5-methyl-2-phenyloxazol-4-y...)Show SMILES Cc1oc(nc1CCOc1ccc(CC(C(O)=O)C(C)(C)C)cn1)-c1ccccc1 Show InChI InChI=1S/C24H28N2O4/c1-16-20(26-22(30-16)18-8-6-5-7-9-18)12-13-29-21-11-10-17(15-25-21)14-19(23(27)28)24(2,3)4/h5-11,15,19H,12-14H2,1-4H3,(H,27,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194964
(2-ethoxy-2-((6-(2-(5-methyl-2-phenyloxazol-4-yl)et...)Show SMILES CCOC(CC)(Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)nc1)C(O)=O Show InChI InChI=1S/C24H28N2O5/c1-4-24(23(27)28,30-5-2)15-18-11-12-21(25-16-18)29-14-13-20-17(3)31-22(26-20)19-9-7-6-8-10-19/h6-12,16H,4-5,13-15H2,1-3H3,(H,27,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.44E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50194978
(3-((6-(2-(5-methyl-2-phenyloxazol-4-yl)ethoxy)pyri...)Show SMILES Cc1oc(nc1CCOc1ccc(CC2(CCOC2)C(O)=O)cn1)-c1ccccc1 Show InChI InChI=1S/C23H24N2O5/c1-16-19(25-21(30-16)18-5-3-2-4-6-18)9-11-29-20-8-7-17(14-24-20)13-23(22(26)27)10-12-28-15-23/h2-8,14H,9-13,15H2,1H3,(H,26,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.70E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global R&D
Curated by ChEMBL
| Assay Description
Displacement of radiolabeled darglitazone from human PPAR gamma by SPA binding assay |
Bioorg Med Chem Lett 16: 6120-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.110
BindingDB Entry DOI: 10.7270/Q20Z72XV |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50483878
(CHEMBL1773312)Show InChI InChI=1S/C17H14FN3O2/c18-12-3-1-11(2-4-12)10-20-7-5-13-14-6-8-21(23)17(22)16(14)19-9-15(13)20/h1-5,7,9,23H,6,8,10H2 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of HIV-1 integrase strand transfer activity by scintillation proximity assay |
J Med Chem 54: 3393-417 (2011)
Article DOI: 10.1021/jm200208d
BindingDB Entry DOI: 10.7270/Q2514236 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50483859
(CHEMBL1773408)Show SMILES CC(C)(O)CCc1cn(Cc2ccc(F)cc2)c2cnc3C(=O)N(O)CCc3c12 Show InChI InChI=1S/C22H24FN3O3/c1-22(2,28)9-7-15-13-25(12-14-3-5-16(23)6-4-14)18-11-24-20-17(19(15)18)8-10-26(29)21(20)27/h3-6,11,13,28-29H,7-10,12H2,1-2H3 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 8.80 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of HIV-1 integrase strand transfer activity by scintillation proximity assay |
J Med Chem 54: 3393-417 (2011)
Article DOI: 10.1021/jm200208d
BindingDB Entry DOI: 10.7270/Q2514236 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50483864
(CHEMBL1773322)Show SMILES ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(CN4CCC(F)(F)C4)c23)C1=O Show InChI InChI=1S/C22H21F3N4O2/c23-16-3-1-14(2-4-16)10-28-12-15(11-27-8-6-22(24,25)13-27)19-17-5-7-29(31)21(30)20(17)26-9-18(19)28/h1-4,9,12,31H,5-8,10-11,13H2 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of HIV-1 integrase strand transfer activity by scintillation proximity assay |
J Med Chem 54: 3393-417 (2011)
Article DOI: 10.1021/jm200208d
BindingDB Entry DOI: 10.7270/Q2514236 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50483863
(CHEMBL1773324)Show SMILES ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(COCc4ccccn4)c23)C1=O Show InChI InChI=1S/C24H21FN4O3/c25-18-6-4-16(5-7-18)12-28-13-17(14-32-15-19-3-1-2-9-26-19)22-20-8-10-29(31)24(30)23(20)27-11-21(22)28/h1-7,9,11,13,31H,8,10,12,14-15H2 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of HIV-1 integrase strand transfer activity by scintillation proximity assay |
J Med Chem 54: 3393-417 (2011)
Article DOI: 10.1021/jm200208d
BindingDB Entry DOI: 10.7270/Q2514236 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50483871
(CHEMBL1773323)Show SMILES ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(COCCc4ccccn4)c23)C1=O Show InChI InChI=1S/C25H23FN4O3/c26-19-6-4-17(5-7-19)14-29-15-18(16-33-12-9-20-3-1-2-10-27-20)23-21-8-11-30(32)25(31)24(21)28-13-22(23)29/h1-7,10,13,15,32H,8-9,11-12,14,16H2 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of HIV-1 integrase strand transfer activity by scintillation proximity assay |
J Med Chem 54: 3393-417 (2011)
Article DOI: 10.1021/jm200208d
BindingDB Entry DOI: 10.7270/Q2514236 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50483856
(CHEMBL1773413)Show SMILES CN(C)S(=O)(=O)c1cn(Cc2ccc(F)cc2)c2cnc3C(=O)N(O)CCc3c12 Show InChI InChI=1S/C19H19FN4O4S/c1-22(2)29(27,28)16-11-23(10-12-3-5-13(20)6-4-12)15-9-21-18-14(17(15)16)7-8-24(26)19(18)25/h3-6,9,11,26H,7-8,10H2,1-2H3 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of HIV-1 integrase strand transfer activity by scintillation proximity assay |
J Med Chem 54: 3393-417 (2011)
Article DOI: 10.1021/jm200208d
BindingDB Entry DOI: 10.7270/Q2514236 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50483868
(CHEMBL1773410)Show SMILES ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(CCC(F)(F)F)c23)C1=O Show InChI InChI=1S/C20H17F4N3O2/c21-14-3-1-12(2-4-14)10-26-11-13(5-7-20(22,23)24)17-15-6-8-27(29)19(28)18(15)25-9-16(17)26/h1-4,9,11,29H,5-8,10H2 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of HIV-1 integrase strand transfer activity by scintillation proximity assay |
J Med Chem 54: 3393-417 (2011)
Article DOI: 10.1021/jm200208d
BindingDB Entry DOI: 10.7270/Q2514236 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50483860
(CHEMBL1773406)Show SMILES ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(CCCN4CCOCC4)c23)C1=O Show InChI InChI=1S/C24H27FN4O3/c25-19-5-3-17(4-6-19)15-28-16-18(2-1-8-27-10-12-32-13-11-27)22-20-7-9-29(31)24(30)23(20)26-14-21(22)28/h3-6,14,16,31H,1-2,7-13,15H2 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of HIV-1 integrase strand transfer activity by scintillation proximity assay |
J Med Chem 54: 3393-417 (2011)
Article DOI: 10.1021/jm200208d
BindingDB Entry DOI: 10.7270/Q2514236 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50483861
(CHEMBL1773405)Show SMILES ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(CCC(O)=O)c23)C1=O Show InChI InChI=1S/C20H18FN3O4/c21-14-4-1-12(2-5-14)10-23-11-13(3-6-17(25)26)18-15-7-8-24(28)20(27)19(15)22-9-16(18)23/h1-2,4-5,9,11,28H,3,6-8,10H2,(H,25,26) | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of HIV-1 integrase strand transfer activity by scintillation proximity assay |
J Med Chem 54: 3393-417 (2011)
Article DOI: 10.1021/jm200208d
BindingDB Entry DOI: 10.7270/Q2514236 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50483862
(CHEMBL1773401)Show SMILES ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(COCC4CCOCC4)c23)C1=O Show InChI InChI=1S/C24H26FN3O4/c25-19-3-1-16(2-4-19)12-27-13-18(15-32-14-17-6-9-31-10-7-17)22-20-5-8-28(30)24(29)23(20)26-11-21(22)27/h1-4,11,13,17,30H,5-10,12,14-15H2 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of HIV-1 integrase strand transfer activity by scintillation proximity assay |
J Med Chem 54: 3393-417 (2011)
Article DOI: 10.1021/jm200208d
BindingDB Entry DOI: 10.7270/Q2514236 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50483858
(CHEMBL1773409)Show SMILES ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(CCCOC4CCOCC4)c23)C1=O Show InChI InChI=1S/C25H28FN3O4/c26-19-5-3-17(4-6-19)15-28-16-18(2-1-11-33-20-8-12-32-13-9-20)23-21-7-10-29(31)25(30)24(21)27-14-22(23)28/h3-6,14,16,20,31H,1-2,7-13,15H2 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of HIV-1 integrase strand transfer activity by scintillation proximity assay |
J Med Chem 54: 3393-417 (2011)
Article DOI: 10.1021/jm200208d
BindingDB Entry DOI: 10.7270/Q2514236 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50483875
(CHEMBL1773403)Show SMILES ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(COCCCc4ccccn4)c23)C1=O Show InChI InChI=1S/C26H25FN4O3/c27-20-8-6-18(7-9-20)15-30-16-19(17-34-13-3-5-21-4-1-2-11-28-21)24-22-10-12-31(33)26(32)25(22)29-14-23(24)30/h1-2,4,6-9,11,14,16,33H,3,5,10,12-13,15,17H2 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of HIV-1 integrase strand transfer activity by scintillation proximity assay |
J Med Chem 54: 3393-417 (2011)
Article DOI: 10.1021/jm200208d
BindingDB Entry DOI: 10.7270/Q2514236 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50483869
(CHEMBL1773407)Show SMILES CN(CCCc1cn(Cc2ccc(F)cc2)c2cnc3C(=O)N(O)CCc3c12)C(C)=O Show InChI InChI=1S/C23H25FN4O3/c1-15(29)26(2)10-3-4-17-14-27(13-16-5-7-18(24)8-6-16)20-12-25-22-19(21(17)20)9-11-28(31)23(22)30/h5-8,12,14,31H,3-4,9-11,13H2,1-2H3 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of HIV-1 integrase strand transfer activity by scintillation proximity assay |
J Med Chem 54: 3393-417 (2011)
Article DOI: 10.1021/jm200208d
BindingDB Entry DOI: 10.7270/Q2514236 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50483852
(CHEMBL1773319)Show SMILES ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(CN4CCCCC4)c23)C1=O Show InChI InChI=1S/C23H25FN4O2/c24-18-6-4-16(5-7-18)13-27-15-17(14-26-9-2-1-3-10-26)21-19-8-11-28(30)23(29)22(19)25-12-20(21)27/h4-7,12,15,30H,1-3,8-11,13-14H2 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of HIV-1 integrase strand transfer activity by scintillation proximity assay |
J Med Chem 54: 3393-417 (2011)
Article DOI: 10.1021/jm200208d
BindingDB Entry DOI: 10.7270/Q2514236 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50483876
(CHEMBL1773318)Show SMILES CN(CCO)Cc1cn(Cc2ccc(F)cc2)c2cnc3C(=O)N(O)CCc3c12 Show InChI InChI=1S/C21H23FN4O3/c1-24(8-9-27)12-15-13-25(11-14-2-4-16(22)5-3-14)18-10-23-20-17(19(15)18)6-7-26(29)21(20)28/h2-5,10,13,27,29H,6-9,11-12H2,1H3 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of HIV-1 integrase strand transfer activity by scintillation proximity assay |
J Med Chem 54: 3393-417 (2011)
Article DOI: 10.1021/jm200208d
BindingDB Entry DOI: 10.7270/Q2514236 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50483877
(CHEMBL1773404)Show SMILES ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(COCc4ccccc4F)c23)C1=O Show InChI InChI=1S/C25H21F2N3O3/c26-19-7-5-16(6-8-19)12-29-13-18(15-33-14-17-3-1-2-4-21(17)27)23-20-9-10-30(32)25(31)24(20)28-11-22(23)29/h1-8,11,13,32H,9-10,12,14-15H2 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of HIV-1 integrase strand transfer activity by scintillation proximity assay |
J Med Chem 54: 3393-417 (2011)
Article DOI: 10.1021/jm200208d
BindingDB Entry DOI: 10.7270/Q2514236 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50483870
(CHEMBL1773402)Show SMILES CC(C)OCCOCc1cn(Cc2ccc(F)cc2)c2cnc3C(=O)N(O)CCc3c12 Show InChI InChI=1S/C23H26FN3O4/c1-15(2)31-10-9-30-14-17-13-26(12-16-3-5-18(24)6-4-16)20-11-25-22-19(21(17)20)7-8-27(29)23(22)28/h3-6,11,13,15,29H,7-10,12,14H2,1-2H3 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 17 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of HIV-1 integrase strand transfer activity by scintillation proximity assay |
J Med Chem 54: 3393-417 (2011)
Article DOI: 10.1021/jm200208d
BindingDB Entry DOI: 10.7270/Q2514236 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50483853
(CHEMBL1773316)Show SMILES ON1CCc2c(ncc3n(Cc4ccc(F)c(Cl)c4C#N)ccc23)C1=O Show InChI InChI=1S/C18H12ClFN4O2/c19-16-13(7-21)10(1-2-14(16)20)9-23-5-3-11-12-4-6-24(26)18(25)17(12)22-8-15(11)23/h1-3,5,8,26H,4,6,9H2 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 17 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of HIV-1 integrase strand transfer activity by scintillation proximity assay |
J Med Chem 54: 3393-417 (2011)
Article DOI: 10.1021/jm200208d
BindingDB Entry DOI: 10.7270/Q2514236 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50483854
(CHEMBL1773314)Show InChI InChI=1S/C16H12F2N4O2/c17-9-5-12(18)13(19-6-9)8-21-3-1-10-11-2-4-22(24)16(23)15(11)20-7-14(10)21/h1,3,5-7,24H,2,4,8H2 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 18 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of HIV-1 integrase strand transfer activity by scintillation proximity assay |
J Med Chem 54: 3393-417 (2011)
Article DOI: 10.1021/jm200208d
BindingDB Entry DOI: 10.7270/Q2514236 |
More data for this
Ligand-Target Pair | |
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