Found 58 hits Enz. Inhib. hit(s) with all data for entry = 50004398 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 |
|---|
Integrase
(Human immunodeficiency virus 1) | BDBM50183273
((S)-6-(3-chloro-2-fluorobenzyl)-1-(1-hydroxy-3-met...)Show SMILES COc1cc2n(cc(C(O)=O)c(=O)c2cc1Cc1cccc(Cl)c1F)[C@H](CO)C(C)C |r| Show InChI InChI=1S/C23H23ClFNO5/c1-12(2)19(11-27)26-10-16(23(29)30)22(28)15-8-14(20(31-3)9-18(15)26)7-13-5-4-6-17(24)21(13)25/h4-6,8-10,12,19,27H,7,11H2,1-3H3,(H,29,30)/t19-/m1/s1 | PDB
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| Article
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| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM25351
(N-[2-(4-{[(4-fluorophenyl)methyl]carbamoyl}-5-hydr...)Show SMILES Cc1nnc(o1)C(=O)NC(C)(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C Show InChI InChI=1S/C20H21FN6O5/c1-10-25-26-17(32-10)16(30)24-20(2,3)19-23-13(14(28)18(31)27(19)4)15(29)22-9-11-5-7-12(21)8-6-11/h5-8,28H,9H2,1-4H3,(H,22,29)(H,24,30) | PDB
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| Article
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| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM25351
(N-[2-(4-{[(4-fluorophenyl)methyl]carbamoyl}-5-hydr...)Show SMILES Cc1nnc(o1)C(=O)NC(C)(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C Show InChI InChI=1S/C20H21FN6O5/c1-10-25-26-17(32-10)16(30)24-20(2,3)19-23-13(14(28)18(31)27(19)4)15(29)22-9-11-5-7-12(21)8-6-11/h5-8,28H,9H2,1-4H3,(H,22,29)(H,24,30) | PDB
UniProtKB/TrEMBL
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| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50183273
((S)-6-(3-chloro-2-fluorobenzyl)-1-(1-hydroxy-3-met...)Show SMILES COc1cc2n(cc(C(O)=O)c(=O)c2cc1Cc1cccc(Cl)c1F)[C@H](CO)C(C)C |r| Show InChI InChI=1S/C23H23ClFNO5/c1-12(2)19(11-27)26-10-16(23(29)30)22(28)15-8-14(20(31-3)9-18(15)26)7-13-5-4-6-17(24)21(13)25/h4-6,8-10,12,19,27H,7,11H2,1-3H3,(H,29,30)/t19-/m1/s1 | PDB
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| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482537
(CHEMBL1213723)Show SMILES COc1cccc2n(Cc3cccc(Cl)c3)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H16ClNO5/c1-27-18-7-3-6-15-19(18)14(16(23)9-17(24)20(25)26)11-22(15)10-12-4-2-5-13(21)8-12/h2-9,11,24H,10H2,1H3,(H,25,26)/b17-9- | PDB
UniProtKB/TrEMBL
B.MOAD
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| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482546
(CHEMBL1213788)Show SMILES COc1cccc2n(Cc3cccc(Cl)c3F)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H15ClFNO5/c1-28-17-7-3-6-14-18(17)12(15(24)8-16(25)20(26)27)10-23(14)9-11-4-2-5-13(21)19(11)22/h2-8,10,25H,9H2,1H3,(H,26,27)/b16-8- | PDB
UniProtKB/TrEMBL
B.MOAD
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| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482530
(CHEMBL1213789)Show SMILES COc1cccc2n(Cc3ccc(F)c(Cl)c3)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H15ClFNO5/c1-28-18-4-2-3-15-19(18)12(16(24)8-17(25)20(26)27)10-23(15)9-11-5-6-14(22)13(21)7-11/h2-8,10,25H,9H2,1H3,(H,26,27)/b17-8- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482527
(CHEMBL1213726)Show SMILES COc1cccc2n(Cc3ccc(F)cc3Cl)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H15ClFNO5/c1-28-18-4-2-3-15-19(18)13(16(24)8-17(25)20(26)27)10-23(15)9-11-5-6-12(22)7-14(11)21/h2-8,10,25H,9H2,1H3,(H,26,27)/b17-8- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 60 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482541
(CHEMBL1214536)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)c(Cl)c2)c2cccc(OC)c12 Show InChI InChI=1S/C22H19ClFNO5/c1-3-30-22(28)19(27)10-18(26)14-12-25(11-13-7-8-16(24)15(23)9-13)17-5-4-6-20(29-2)21(14)17/h4-10,12,27H,3,11H2,1-2H3/b19-10- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50009453
(CHEMBL259011 | CHI-1043)Show SMILES COc1cccc2n(Cc3ccc(F)cc3)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H16FNO5/c1-27-18-4-2-3-15-19(18)14(16(23)9-17(24)20(25)26)11-22(15)10-12-5-7-13(21)8-6-12/h2-9,11,24H,10H2,1H3,(H,25,26)/b17-9- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 80 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482540
(CHEMBL1213791)Show SMILES COc1cccc2n(Cc3cc(Cl)ccc3F)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H15ClFNO5/c1-28-18-4-2-3-15-19(18)13(16(24)8-17(25)20(26)27)10-23(15)9-11-7-12(21)5-6-14(11)22/h2-8,10,25H,9H2,1H3,(H,26,27)/b17-8- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 90 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482530
(CHEMBL1213789)Show SMILES COc1cccc2n(Cc3ccc(F)c(Cl)c3)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H15ClFNO5/c1-28-18-4-2-3-15-19(18)12(16(24)8-17(25)20(26)27)10-23(15)9-11-5-6-14(22)13(21)7-11/h2-8,10,25H,9H2,1H3,(H,26,27)/b17-8- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 120 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482529
(CHEMBL1213787)Show SMILES COc1cccc2n(Cc3c(F)cccc3Cl)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H15ClFNO5/c1-28-18-7-3-6-15-19(18)12(16(24)8-17(25)20(26)27)10-23(15)9-11-13(21)4-2-5-14(11)22/h2-8,10,25H,9H2,1H3,(H,26,27)/b17-8- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 130 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482537
(CHEMBL1213723)Show SMILES COc1cccc2n(Cc3cccc(Cl)c3)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H16ClNO5/c1-27-18-7-3-6-15-19(18)14(16(23)9-17(24)20(25)26)11-22(15)10-12-4-2-5-13(21)8-12/h2-9,11,24H,10H2,1H3,(H,25,26)/b17-9- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 130 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50009453
(CHEMBL259011 | CHI-1043)Show SMILES COc1cccc2n(Cc3ccc(F)cc3)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H16FNO5/c1-27-18-4-2-3-15-19(18)14(16(23)9-17(24)20(25)26)11-22(15)10-12-5-7-13(21)8-6-12/h2-9,11,24H,10H2,1H3,(H,25,26)/b17-9- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482531
(CHEMBL1213790)Show SMILES COc1cccc2n(Cc3cc(F)cc(Cl)c3)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H15ClFNO5/c1-28-18-4-2-3-15-19(18)14(16(24)8-17(25)20(26)27)10-23(15)9-11-5-12(21)7-13(22)6-11/h2-8,10,25H,9H2,1H3,(H,26,27)/b17-8- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 240 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482531
(CHEMBL1213790)Show SMILES COc1cccc2n(Cc3cc(F)cc(Cl)c3)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H15ClFNO5/c1-28-18-4-2-3-15-19(18)14(16(24)8-17(25)20(26)27)10-23(15)9-11-5-12(21)7-13(22)6-11/h2-8,10,25H,9H2,1H3,(H,26,27)/b17-8- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 250 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482528
(CHEMBL1213727)Show SMILES COc1cccc2n(Cc3cc(F)ccc3Cl)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H15ClFNO5/c1-28-18-4-2-3-15-19(18)13(16(24)8-17(25)20(26)27)10-23(15)9-11-7-12(22)5-6-14(11)21/h2-8,10,25H,9H2,1H3,(H,26,27)/b17-8- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 270 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482540
(CHEMBL1213791)Show SMILES COc1cccc2n(Cc3cc(Cl)ccc3F)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H15ClFNO5/c1-28-18-4-2-3-15-19(18)13(16(24)8-17(25)20(26)27)10-23(15)9-11-7-12(21)5-6-14(11)22/h2-8,10,25H,9H2,1H3,(H,26,27)/b17-8- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 320 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482541
(CHEMBL1214536)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)c(Cl)c2)c2cccc(OC)c12 Show InChI InChI=1S/C22H19ClFNO5/c1-3-30-22(28)19(27)10-18(26)14-12-25(11-13-7-8-16(24)15(23)9-13)17-5-4-6-20(29-2)21(14)17/h4-10,12,27H,3,11H2,1-2H3/b19-10- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 360 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482528
(CHEMBL1213727)Show SMILES COc1cccc2n(Cc3cc(F)ccc3Cl)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H15ClFNO5/c1-28-18-4-2-3-15-19(18)13(16(24)8-17(25)20(26)27)10-23(15)9-11-7-12(22)5-6-14(11)21/h2-8,10,25H,9H2,1H3,(H,26,27)/b17-8- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 420 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482536
(CHEMBL1214587)Show SMILES COc1cccc2n(Cc3ccccc3Cl)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H16ClNO5/c1-27-18-8-4-7-15-19(18)13(16(23)9-17(24)20(25)26)11-22(15)10-12-5-2-3-6-14(12)21/h2-9,11,24H,10H2,1H3,(H,25,26)/b17-9- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 520 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482529
(CHEMBL1213787)Show SMILES COc1cccc2n(Cc3c(F)cccc3Cl)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H15ClFNO5/c1-28-18-7-3-6-15-19(18)12(16(24)8-17(25)20(26)27)10-23(15)9-11-13(21)4-2-5-14(11)22/h2-8,10,25H,9H2,1H3,(H,26,27)/b17-8- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 530 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482527
(CHEMBL1213726)Show SMILES COc1cccc2n(Cc3ccc(F)cc3Cl)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H15ClFNO5/c1-28-18-4-2-3-15-19(18)13(16(24)8-17(25)20(26)27)10-23(15)9-11-5-6-12(22)7-14(11)21/h2-8,10,25H,9H2,1H3,(H,26,27)/b17-8- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 540 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482526
(CHEMBL1213724)Show SMILES COc1cccc2n(Cc3ccc(Cl)cc3)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H16ClNO5/c1-27-18-4-2-3-15-19(18)14(16(23)9-17(24)20(25)26)11-22(15)10-12-5-7-13(21)8-6-12/h2-9,11,24H,10H2,1H3,(H,25,26)/b17-9- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 590 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482536
(CHEMBL1214587)Show SMILES COc1cccc2n(Cc3ccccc3Cl)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H16ClNO5/c1-27-18-8-4-7-15-19(18)13(16(23)9-17(24)20(25)26)11-22(15)10-12-5-2-3-6-14(12)21/h2-9,11,24H,10H2,1H3,(H,25,26)/b17-9- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 710 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482543
(CHEMBL1214417)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccccc2Cl)c2cccc(OC)c12 Show InChI InChI=1S/C22H20ClNO5/c1-3-29-22(27)19(26)11-18(25)15-13-24(12-14-7-4-5-8-16(14)23)17-9-6-10-20(28-2)21(15)17/h4-11,13,26H,3,12H2,1-2H3/b19-11- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 730 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482522
(CHEMBL1214535)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cccc(Cl)c2F)c2cccc(OC)c12 Show InChI InChI=1S/C22H19ClFNO5/c1-3-30-22(28)18(27)10-17(26)14-12-25(11-13-6-4-7-15(23)21(13)24)16-8-5-9-19(29-2)20(14)16/h4-10,12,27H,3,11H2,1-2H3/b18-10- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 740 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482546
(CHEMBL1213788)Show SMILES COc1cccc2n(Cc3cccc(Cl)c3F)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H15ClFNO5/c1-28-17-7-3-6-14-18(17)12(15(24)8-16(25)20(26)27)10-23(14)9-11-4-2-5-13(21)19(11)22/h2-8,10,25H,9H2,1H3,(H,26,27)/b16-8- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 740 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482524
(CHEMBL1214584)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cc(Cl)ccc2F)c2cccc(OC)c12 Show InChI InChI=1S/C22H19ClFNO5/c1-3-30-22(28)19(27)10-18(26)15-12-25(11-13-9-14(23)7-8-16(13)24)17-5-4-6-20(29-2)21(15)17/h4-10,12,27H,3,11H2,1-2H3/b19-10- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 890 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482526
(CHEMBL1213724)Show SMILES COc1cccc2n(Cc3ccc(Cl)cc3)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H16ClNO5/c1-27-18-4-2-3-15-19(18)14(16(23)9-17(24)20(25)26)11-22(15)10-12-5-7-13(21)8-6-12/h2-9,11,24H,10H2,1H3,(H,25,26)/b17-9- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.02E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482525
(CHEMBL1214585)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(Cl)cc2F)c2cccc(OC)c12 Show InChI InChI=1S/C22H19ClFNO5/c1-3-30-22(28)19(27)10-18(26)15-12-25(11-13-7-8-14(23)9-16(13)24)17-5-4-6-20(29-2)21(15)17/h4-10,12,27H,3,11H2,1-2H3/b19-10- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.15E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482521
(CHEMBL1214534)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2c(F)cccc2Cl)c2cccc(OC)c12 Show InChI InChI=1S/C22H19ClFNO5/c1-3-30-22(28)19(27)10-18(26)14-12-25(11-13-15(23)6-4-7-16(13)24)17-8-5-9-20(29-2)21(14)17/h4-10,12,27H,3,11H2,1-2H3/b19-10- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482523
(CHEMBL1214583)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cc(F)cc(Cl)c2)c2cccc(OC)c12 Show InChI InChI=1S/C22H19ClFNO5/c1-3-30-22(28)19(27)10-18(26)16-12-25(11-13-7-14(23)9-15(24)8-13)17-5-4-6-20(29-2)21(16)17/h4-10,12,27H,3,11H2,1-2H3/b19-10- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482522
(CHEMBL1214535)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cccc(Cl)c2F)c2cccc(OC)c12 Show InChI InChI=1S/C22H19ClFNO5/c1-3-30-22(28)18(27)10-17(26)14-12-25(11-13-6-4-7-15(23)21(13)24)16-8-5-9-19(29-2)20(14)16/h4-10,12,27H,3,11H2,1-2H3/b18-10- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.37E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482534
(CHEMBL1214480)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cccc(F)c2Cl)c2cccc(OC)c12 Show InChI InChI=1S/C22H19ClFNO5/c1-3-30-22(28)18(27)10-17(26)14-12-25(11-13-6-4-7-15(24)21(13)23)16-8-5-9-19(29-2)20(14)16/h4-10,12,27H,3,11H2,1-2H3/b18-10- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.39E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482524
(CHEMBL1214584)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cc(Cl)ccc2F)c2cccc(OC)c12 Show InChI InChI=1S/C22H19ClFNO5/c1-3-30-22(28)19(27)10-18(26)15-12-25(11-13-9-14(23)7-8-16(13)24)17-5-4-6-20(29-2)21(15)17/h4-10,12,27H,3,11H2,1-2H3/b19-10- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.61E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482544
(CHEMBL1214481)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2Cl)c2cccc(OC)c12 Show InChI InChI=1S/C22H19ClFNO5/c1-3-30-22(28)19(27)10-18(26)15-12-25(11-13-7-8-14(24)9-16(13)23)17-5-4-6-20(29-2)21(15)17/h4-10,12,27H,3,11H2,1-2H3/b19-10- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.74E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482542
(CHEMBL1213849)Show SMILES COc1cccc2n(Cc3ccc(Cl)cc3F)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H15ClFNO5/c1-28-18-4-2-3-15-19(18)13(16(24)8-17(25)20(26)27)10-23(15)9-11-5-6-12(21)7-14(11)22/h2-8,10,25H,9H2,1H3,(H,26,27)/b17-8- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.53E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482544
(CHEMBL1214481)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2Cl)c2cccc(OC)c12 Show InChI InChI=1S/C22H19ClFNO5/c1-3-30-22(28)19(27)10-18(26)15-12-25(11-13-7-8-14(24)9-16(13)23)17-5-4-6-20(29-2)21(15)17/h4-10,12,27H,3,11H2,1-2H3/b19-10- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.56E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482535
(CHEMBL1214533)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cc(F)ccc2Cl)c2cccc(OC)c12 Show InChI InChI=1S/C22H19ClFNO5/c1-3-30-22(28)19(27)10-18(26)15-12-25(11-13-9-14(24)7-8-16(13)23)17-5-4-6-20(29-2)21(15)17/h4-10,12,27H,3,11H2,1-2H3/b19-10- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482521
(CHEMBL1214534)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2c(F)cccc2Cl)c2cccc(OC)c12 Show InChI InChI=1S/C22H19ClFNO5/c1-3-30-22(28)19(27)10-18(26)14-12-25(11-13-15(23)6-4-7-16(13)24)17-8-5-9-20(29-2)21(14)17/h4-10,12,27H,3,11H2,1-2H3/b19-10- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.86E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482533
(CHEMBL1214478)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cccc(Cl)c2)c2cccc(OC)c12 Show InChI InChI=1S/C22H20ClNO5/c1-3-29-22(27)19(26)11-18(25)16-13-24(12-14-6-4-7-15(23)10-14)17-8-5-9-20(28-2)21(16)17/h4-11,13,26H,3,12H2,1-2H3/b19-11- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.89E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482535
(CHEMBL1214533)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cc(F)ccc2Cl)c2cccc(OC)c12 Show InChI InChI=1S/C22H19ClFNO5/c1-3-30-22(28)19(27)10-18(26)15-12-25(11-13-9-14(24)7-8-16(13)23)17-5-4-6-20(29-2)21(15)17/h4-10,12,27H,3,11H2,1-2H3/b19-10- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.94E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482523
(CHEMBL1214583)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cc(F)cc(Cl)c2)c2cccc(OC)c12 Show InChI InChI=1S/C22H19ClFNO5/c1-3-30-22(28)19(27)10-18(26)16-12-25(11-13-7-14(23)9-15(24)8-13)17-5-4-6-20(29-2)21(16)17/h4-10,12,27H,3,11H2,1-2H3/b19-10- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.17E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482525
(CHEMBL1214585)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(Cl)cc2F)c2cccc(OC)c12 Show InChI InChI=1S/C22H19ClFNO5/c1-3-30-22(28)19(27)10-18(26)15-12-25(11-13-7-8-14(23)9-16(13)24)17-5-4-6-20(29-2)21(15)17/h4-10,12,27H,3,11H2,1-2H3/b19-10- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.32E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482532
(CHEMBL1213850)Show SMILES COc1cccc2n(Cc3ccc(Cl)c(F)c3)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H15ClFNO5/c1-28-18-4-2-3-15-19(18)12(16(24)8-17(25)20(26)27)10-23(15)9-11-5-6-13(21)14(22)7-11/h2-8,10,25H,9H2,1H3,(H,26,27)/b17-8- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.33E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482532
(CHEMBL1213850)Show SMILES COc1cccc2n(Cc3ccc(Cl)c(F)c3)cc(C(=O)\C=C(/O)C(O)=O)c12 Show InChI InChI=1S/C20H15ClFNO5/c1-28-18-4-2-3-15-19(18)12(16(24)8-17(25)20(26)27)10-23(15)9-11-5-6-13(21)14(22)7-11/h2-8,10,25H,9H2,1H3,(H,26,27)/b17-8- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 4.58E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase strand transfer |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482533
(CHEMBL1214478)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cccc(Cl)c2)c2cccc(OC)c12 Show InChI InChI=1S/C22H20ClNO5/c1-3-29-22(27)19(26)11-18(25)16-13-24(12-14-6-4-7-15(23)10-14)17-8-5-9-20(28-2)21(16)17/h4-11,13,26H,3,12H2,1-2H3/b19-11- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 4.78E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM50482545
(CHEMBL1214586)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(Cl)c(F)c2)c2cccc(OC)c12 Show InChI InChI=1S/C22H19ClFNO5/c1-3-30-22(28)19(27)10-18(26)14-12-25(11-13-7-8-15(23)16(24)9-13)17-5-4-6-20(29-2)21(14)17/h4-10,12,27H,3,11H2,1-2H3/b19-10- | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 5.05E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Messina
Curated by ChEMBL
| Assay Description
Inhibition of HIV1 integrase |
Bioorg Med Chem 18: 5510-8 (2010)
Article DOI: 10.1016/j.bmc.2010.06.063
BindingDB Entry DOI: 10.7270/Q2Z322G6 |
More data for this
Ligand-Target Pair | |
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