Found 38 hits with Last Name = 'darkes' and Initial = 'm' 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 |
|---|
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339989
(3,5-dichloro-N-(3-(4-((6-chloropyridin-2-yloxy)(4-...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1cccc(Cl)n1)c1ccc(cc1)S(C)(=O)=O Show InChI InChI=1S/C28H31Cl3N4O4S/c1-18(10-13-33-28(36)26-22(29)16-32-17-23(26)30)35-14-11-20(12-15-35)27(39-25-5-3-4-24(31)34-25)19-6-8-21(9-7-19)40(2,37)38/h3-9,16-18,20,27H,10-15H2,1-2H3,(H,33,36) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339987
(3,5-dichloro-N-(3-(4-((6-chloropyridin-2-yloxy)(4-...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1cccc(Cl)n1)c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C28H28Cl3F3N4O2/c1-17(9-12-36-27(39)25-21(29)15-35-16-22(25)30)38-13-10-19(11-14-38)26(40-24-4-2-3-23(31)37-24)18-5-7-20(8-6-18)28(32,33)34/h2-8,15-17,19,26H,9-14H2,1H3,(H,36,39) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339990
(3,5-dichloro-N-(3-(4-((pyridin-2-yloxy)(4-(trifluo...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1ccccn1)c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C28H29Cl2F3N4O2/c1-18(9-13-36-27(38)25-22(29)16-34-17-23(25)30)37-14-10-20(11-15-37)26(39-24-4-2-3-12-35-24)19-5-7-21(8-6-19)28(31,32)33/h2-8,12,16-18,20,26H,9-11,13-15H2,1H3,(H,36,38) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339967
(CHEMBL1762313 | N-(3-(4-(benzyl(4-bromophenyl)amin...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)N(Cc1ccccc1)c1ccc(Br)cc1 Show InChI InChI=1S/C28H31BrCl2N4O/c1-20(11-14-33-28(36)27-25(30)17-32-18-26(27)31)34-15-12-24(13-16-34)35(19-21-5-3-2-4-6-21)23-9-7-22(29)8-10-23/h2-10,17-18,20,24H,11-16,19H2,1H3,(H,33,36) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339969
(3,5-dichloro-N-(3-(4-(2-(4-(trifluoromethyl)phenyl...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C1(Oc2ccccc2O1)c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C29H28Cl2F3N3O3/c1-18(10-13-36-27(38)26-22(30)16-35-17-23(26)31)37-14-11-20(12-15-37)28(39-24-4-2-3-5-25(24)40-28)19-6-8-21(9-7-19)29(32,33)34/h2-9,16-18,20H,10-15H2,1H3,(H,36,38) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339988
(3,5-dichloro-N-(3-(4-((6-chloropyridin-2-yloxy)(4-...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1cccc(Cl)n1)c1ccc(OC(F)(F)F)cc1 Show InChI InChI=1S/C28H28Cl3F3N4O3/c1-17(9-12-36-27(39)25-21(29)15-35-16-22(25)30)38-13-10-19(11-14-38)26(40-24-4-2-3-23(31)37-24)18-5-7-20(8-6-18)41-28(32,33)34/h2-8,15-17,19,26H,9-14H2,1H3,(H,36,39) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339975
(3,5-dichloro-N-(3-(4-((3-fluorophenoxy)(4-(trifluo...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1cccc(F)c1)c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C29H29Cl2F4N3O2/c1-18(9-12-37-28(39)26-24(30)16-36-17-25(26)31)38-13-10-20(11-14-38)27(40-23-4-2-3-22(32)15-23)19-5-7-21(8-6-19)29(33,34)35/h2-8,15-18,20,27H,9-14H2,1H3,(H,37,39) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339992
(3,5-dichloro-N-(3-(4-((6-cyanopyridin-2-yloxy)(4-(...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1cccc(n1)C#N)c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C29H28Cl2F3N5O2/c1-18(9-12-37-28(40)26-23(30)16-36-17-24(26)31)39-13-10-20(11-14-39)27(41-25-4-2-3-22(15-35)38-25)19-5-7-21(8-6-19)29(32,33)34/h2-8,16-18,20,27H,9-14H2,1H3,(H,37,40) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50104931
((4-{(4-Bromo-phenyl)-[(E)-ethoxyimino]-methyl}-4''...)Show SMILES CCO[N-][C+](C1CCN(CC1)C1(C)CCN(CC1)C(=O)c1c(C)cc[n+]([O-])c1C)c1ccc(Br)cc1 Show InChI InChI=1S/C28H37BrN4O3/c1-5-36-30-26(22-6-8-24(29)9-7-22)23-11-15-32(16-12-23)28(4)13-18-31(19-14-28)27(34)25-20(2)10-17-33(35)21(25)3/h6-10,17,23H,5,11-16,18-19H2,1-4H3 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339984
(3,5-dichloro-N-(3-(4-((6-methylpyridin-2-yloxy)(4-...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1cccc(C)n1)c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C29H31Cl2F3N4O2/c1-18-4-3-5-25(37-18)40-27(20-6-8-22(9-7-20)29(32,33)34)21-11-14-38(15-12-21)19(2)10-13-36-28(39)26-23(30)16-35-17-24(26)31/h3-9,16-17,19,21,27H,10-15H2,1-2H3,(H,36,39) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339968
(3,5-dichloro-N-(3-(4-(2-(4-(trifluoromethyl)phenyl...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C1(Cc2ccccc2O1)c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C30H30Cl2F3N3O2/c1-19(10-13-37-28(39)27-24(31)17-36-18-25(27)32)38-14-11-22(12-15-38)29(16-20-4-2-3-5-26(20)40-29)21-6-8-23(9-7-21)30(33,34)35/h2-9,17-19,22H,10-16H2,1H3,(H,37,39) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339983
(3,5-dichloro-N-(3-(4-((4-methylpyridin-2-yloxy)(4-...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1cc(C)ccn1)c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C29H31Cl2F3N4O2/c1-18-7-11-36-25(15-18)40-27(20-3-5-22(6-4-20)29(32,33)34)21-9-13-38(14-10-21)19(2)8-12-37-28(39)26-23(30)16-35-17-24(26)31/h3-7,11,15-17,19,21,27H,8-10,12-14H2,1-2H3,(H,37,39) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339970
(3,5-dichloro-N-(3-(4-(phenoxy(4-(trifluoromethyl)p...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1ccccc1)c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C29H30Cl2F3N3O2/c1-19(11-14-36-28(38)26-24(30)17-35-18-25(26)31)37-15-12-21(13-16-37)27(39-23-5-3-2-4-6-23)20-7-9-22(10-8-20)29(32,33)34/h2-10,17-19,21,27H,11-16H2,1H3,(H,36,38) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339972
(3,5-dichloro-N-(3-(4-((3-cyanophenoxy)(4-(trifluor...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1cccc(c1)C#N)c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C30H29Cl2F3N4O2/c1-19(9-12-38-29(40)27-25(31)17-37-18-26(27)32)39-13-10-22(11-14-39)28(41-24-4-2-3-20(15-24)16-36)21-5-7-23(8-6-21)30(33,34)35/h2-8,15,17-19,22,28H,9-14H2,1H3,(H,38,40) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339974
(3,5-dichloro-N-(3-(4-((3-chlorophenoxy)(4-(trifluo...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1cccc(Cl)c1)c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C29H29Cl3F3N3O2/c1-18(9-12-37-28(39)26-24(31)16-36-17-25(26)32)38-13-10-20(11-14-38)27(40-23-4-2-3-22(30)15-23)19-5-7-21(8-6-19)29(33,34)35/h2-8,15-18,20,27H,9-14H2,1H3,(H,37,39) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 60 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339982
(3,5-dichloro-N-(3-(4-((3-methylpyridin-2-yloxy)(4-...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1ncccc1C)c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C29H31Cl2F3N4O2/c1-18-4-3-12-37-28(18)40-26(20-5-7-22(8-6-20)29(32,33)34)21-10-14-38(15-11-21)19(2)9-13-36-27(39)25-23(30)16-35-17-24(25)31/h3-8,12,16-17,19,21,26H,9-11,13-15H2,1-2H3,(H,36,39) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 60 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339986
(3,5-dichloro-N-(3-(4-((4-chloropyridin-2-yloxy)(4-...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1cc(Cl)ccn1)c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C28H28Cl3F3N4O2/c1-17(6-10-37-27(39)25-22(30)15-35-16-23(25)31)38-12-8-19(9-13-38)26(40-24-14-21(29)7-11-36-24)18-2-4-20(5-3-18)28(32,33)34/h2-5,7,11,14-17,19,26H,6,8-10,12-13H2,1H3,(H,37,39) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339971
(3,5-dichloro-N-(3-(4-((2-cyanophenoxy)(4-(trifluor...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1ccccc1C#N)c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C30H29Cl2F3N4O2/c1-19(10-13-38-29(40)27-24(31)17-37-18-25(27)32)39-14-11-21(12-15-39)28(41-26-5-3-2-4-22(26)16-36)20-6-8-23(9-7-20)30(33,34)35/h2-9,17-19,21,28H,10-15H2,1H3,(H,38,40) | PDB
KEGG
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B.MOAD
DrugBank
antibodypedia
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PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339973
(3,5-dichloro-N-(3-(4-((2-chlorophenoxy)(4-(trifluo...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1ccccc1Cl)c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C29H29Cl3F3N3O2/c1-18(10-13-37-28(39)26-23(31)16-36-17-24(26)32)38-14-11-20(12-15-38)27(40-25-5-3-2-4-22(25)30)19-6-8-21(9-7-19)29(33,34)35/h2-9,16-18,20,27H,10-15H2,1H3,(H,37,39) | PDB
KEGG
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B.MOAD
DrugBank
antibodypedia
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 120 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339966
(CHEMBL1762312 | N-(3-(4-((4-bromophenyl)(phenoxy)m...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1ccccc1)c1ccc(Br)cc1 Show InChI InChI=1S/C28H30BrCl2N3O2/c1-19(11-14-33-28(35)26-24(30)17-32-18-25(26)31)34-15-12-21(13-16-34)27(20-7-9-22(29)10-8-20)36-23-5-3-2-4-6-23/h2-10,17-19,21,27H,11-16H2,1H3,(H,33,35) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 130 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339991
(3,5-dichloro-N-(3-(4-((4-(trifluoromethyl)phenyl)(...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1cccc(n1)C(F)(F)F)c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C29H28Cl2F6N4O2/c1-17(9-12-39-27(42)25-21(30)15-38-16-22(25)31)41-13-10-19(11-14-41)26(18-5-7-20(8-6-18)28(32,33)34)43-24-4-2-3-23(40-24)29(35,36)37/h2-8,15-17,19,26H,9-14H2,1H3,(H,39,42) | PDB
KEGG
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DrugBank
antibodypedia
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PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 130 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339961
((E)-N-(3-(4-((4-bromophenyl)(ethoxyimino)methyl)pi...)Show SMILES CCO\N=C(/C1CCN(CC1)C(C)CCNC(=O)c1c(Cl)cncc1Cl)c1ccc(Br)cc1 Show InChI InChI=1S/C24H29BrCl2N4O2/c1-3-33-30-23(17-4-6-19(25)7-5-17)18-9-12-31(13-10-18)16(2)8-11-29-24(32)22-20(26)14-28-15-21(22)27/h4-7,14-16,18H,3,8-13H2,1-2H3,(H,29,32)/b30-23- | PDB
KEGG
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PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 130 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339976
(CHEMBL1762326 | N-(3-(4-((4-bromophenyl)(pyridin-2...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1ccccn1)c1ccc(Br)cc1 Show InChI InChI=1S/C27H29BrCl2N4O2/c1-18(9-13-33-27(35)25-22(29)16-31-17-23(25)30)34-14-10-20(11-15-34)26(19-5-7-21(28)8-6-19)36-24-4-2-3-12-32-24/h2-8,12,16-18,20,26H,9-11,13-15H2,1H3,(H,33,35) | PDB
KEGG
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antibodypedia
GoogleScholar
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| CHEMBL
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PC sid
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| Article
PubMed
| n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339985
(3,5-dichloro-N-(3-(4-((3-chloropyridin-2-yloxy)(4-...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1ncccc1Cl)c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C28H28Cl3F3N4O2/c1-17(8-12-36-26(39)24-22(30)15-35-16-23(24)31)38-13-9-19(10-14-38)25(40-27-21(29)3-2-11-37-27)18-4-6-20(7-5-18)28(32,33)34/h2-7,11,15-17,19,25H,8-10,12-14H2,1H3,(H,36,39) | PDB
KEGG
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DrugBank
antibodypedia
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| CHEMBL
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PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339979
(CHEMBL1762330 | N-(3-(4-((4-bromophenyl)(4-methylp...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1cc(C)ccn1)c1ccc(Br)cc1 Show InChI InChI=1S/C28H31BrCl2N4O2/c1-18-7-11-33-25(15-18)37-27(20-3-5-22(29)6-4-20)21-9-13-35(14-10-21)19(2)8-12-34-28(36)26-23(30)16-32-17-24(26)31/h3-7,11,15-17,19,21,27H,8-10,12-14H2,1-2H3,(H,34,36) | PDB
KEGG
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B.MOAD
DrugBank
antibodypedia
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 |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339957
((E)-3-(3-(4-((4-bromophenyl)(ethoxyimino)methyl)pi...)Show SMILES CCO[N-][C+](C1CCN(CCCNC(=O)c2c(C)cc[n+]([O-])c2C)CC1)c1ccc(Br)cc1 Show InChI InChI=1S/C25H33BrN4O3/c1-4-33-28-24(20-6-8-22(26)9-7-20)21-11-15-29(16-12-21)14-5-13-27-25(31)23-18(2)10-17-30(32)19(23)3/h6-10,17,21H,4-5,11-16H2,1-3H3,(H,27,31) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 180 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339978
(CHEMBL1762329 | N-(3-(4-((4-bromophenyl)(3-methylp...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1ncccc1C)c1ccc(Br)cc1 Show InChI InChI=1S/C28H31BrCl2N4O2/c1-18-4-3-12-34-28(18)37-26(20-5-7-22(29)8-6-20)21-10-14-35(15-11-21)19(2)9-13-33-27(36)25-23(30)16-32-17-24(25)31/h3-8,12,16-17,19,21,26H,9-11,13-15H2,1-2H3,(H,33,36) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
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| CHEMBL
PC cid
PC sid
UniChem
Patents
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| Article
PubMed
| n/a | n/a | 190 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339981
(CHEMBL1762332 | N-(3-(4-((4-bromophenyl)(6-methylp...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1cccc(C)n1)c1ccc(Br)cc1 Show InChI InChI=1S/C28H31BrCl2N4O2/c1-18-4-3-5-25(34-18)37-27(20-6-8-22(29)9-7-20)21-11-14-35(15-12-21)19(2)10-13-33-28(36)26-23(30)16-32-17-24(26)31/h3-9,16-17,19,21,27H,10-15H2,1-2H3,(H,33,36) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 220 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339959
((E)-3-(3-(4-((4-bromophenyl)(ethoxyimino)methyl)pi...)Show SMILES CCO[N-][C+](C1CCN(CC1)C(C)CCNC(=O)c1c(C)cc[n+]([O-])c1C)c1ccc(Br)cc1 Show InChI InChI=1S/C26H35BrN4O3/c1-5-34-29-25(21-6-8-23(27)9-7-21)22-12-15-30(16-13-22)19(3)10-14-28-26(32)24-18(2)11-17-31(33)20(24)4/h6-9,11,17,19,22H,5,10,12-16H2,1-4H3,(H,28,32) | PDB
KEGG
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DrugBank
antibodypedia
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 290 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339977
(CHEMBL1762327 | N-(3-(4-((4-bromophenyl)(pyridin-3...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1cccnc1)c1ccc(Br)cc1 Show InChI InChI=1S/C27H29BrCl2N4O2/c1-18(8-12-33-27(35)25-23(29)16-32-17-24(25)30)34-13-9-20(10-14-34)26(19-4-6-21(28)7-5-19)36-22-3-2-11-31-15-22/h2-7,11,15-18,20,26H,8-10,12-14H2,1H3,(H,33,35) | PDB
KEGG
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antibodypedia
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PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 970 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339993
(CHEMBL1762468 | methyl 6-((1-(4-(3,5-dichloroisoni...)Show SMILES COC(=O)c1cccc(OC(C2CCN(CC2)C(C)CCNC(=O)c2c(Cl)cncc2Cl)c2ccc(cc2)C(F)(F)F)n1 Show InChI InChI=1S/C30H31Cl2F3N4O4/c1-18(10-13-37-28(40)26-22(31)16-36-17-23(26)32)39-14-11-20(12-15-39)27(19-6-8-21(9-7-19)30(33,34)35)43-25-5-3-4-24(38-25)29(41)42-2/h3-9,16-18,20,27H,10-15H2,1-2H3,(H,37,40) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.05E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339963
((E)-N-(3-(4-((4-bromophenyl)(ethoxyimino)methyl)pi...)Show SMILES CCO\N=C(/C1CCN(CC1)C(C)(C)CCNC(=O)c1c(Cl)cncc1Cl)c1ccc(Br)cc1 Show InChI InChI=1S/C25H31BrCl2N4O2/c1-4-34-31-23(17-5-7-19(26)8-6-17)18-9-13-32(14-10-18)25(2,3)11-12-30-24(33)22-20(27)15-29-16-21(22)28/h5-8,15-16,18H,4,9-14H2,1-3H3,(H,30,33)/b31-23- | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.76E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339965
(CHEMBL1762311 | N-(3-(4-((4-bromophenyl)(hydroxy)m...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(O)c1ccc(Br)cc1 Show InChI InChI=1S/C22H26BrCl2N3O2/c1-14(6-9-27-22(30)20-18(24)12-26-13-19(20)25)28-10-7-16(8-11-28)21(29)15-2-4-17(23)5-3-15/h2-5,12-14,16,21,29H,6-11H2,1H3,(H,27,30) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.39E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339980
(CHEMBL1762331 | N-(3-(4-((4-bromophenyl)(5-methylp...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C(Oc1ccc(C)cn1)c1ccc(Br)cc1 Show InChI InChI=1S/C28H31BrCl2N4O2/c1-18-3-8-25(34-15-18)37-27(20-4-6-22(29)7-5-20)21-10-13-35(14-11-21)19(2)9-12-33-28(36)26-23(30)16-32-17-24(26)31/h3-8,15-17,19,21,27H,9-14H2,1-2H3,(H,33,36) | PDB
KEGG
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B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339960
((E)-3-((3-(4-((4-bromophenyl)(ethoxyimino)methyl)p...)Show SMILES CCO[N-][C+](C1CCN(CC1)C(C)CCN(C)C(=O)c1c(C)cc[n+]([O-])c1C)c1ccc(Br)cc1 Show InChI InChI=1S/C27H37BrN4O3/c1-6-35-29-26(22-7-9-24(28)10-8-22)23-13-16-31(17-14-23)20(3)12-15-30(5)27(33)25-19(2)11-18-32(34)21(25)4/h7-11,18,20,23H,6,12-17H2,1-5H3 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.62E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339964
(CHEMBL1762309 | N-(3-(4-(7-bromo-1H-benzo[d][1,2]o...)Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C1=NOCc2cc(Br)ccc12 |t:23| Show InChI InChI=1S/C23H25BrCl2N4O2/c1-14(4-7-28-23(31)21-19(25)11-27-12-20(21)26)30-8-5-15(6-9-30)22-18-3-2-17(24)10-16(18)13-32-29-22/h2-3,10-12,14-15H,4-9,13H2,1H3,(H,28,31) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.23E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339958
((E)-3-(2-(4-((4-bromophenyl)(ethoxyimino)methyl)pi...)Show SMILES CCO[N-][C+](C1CCN(CC1)C(C)CNC(=O)c1c(C)cc[n+]([O-])c1C)c1ccc(Br)cc1 Show InChI InChI=1S/C25H33BrN4O3/c1-5-33-28-24(20-6-8-22(26)9-7-20)21-11-13-29(14-12-21)18(3)16-27-25(31)23-17(2)10-15-30(32)19(23)4/h6-10,15,18,21H,5,11-14,16H2,1-4H3,(H,27,31) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.70E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 5
(Homo sapiens (Human)) | BDBM50339962
((E)-N-(2-(1-(4-((4-bromophenyl)(ethoxyimino)methyl...)Show SMILES CCO\N=C(/C1CCN(CC1)C1(CCNC(=O)c2c(Cl)cncc2Cl)CC1)c1ccc(Br)cc1 Show InChI InChI=1S/C25H29BrCl2N4O2/c1-2-34-31-23(17-3-5-19(26)6-4-17)18-7-13-32(14-8-18)25(9-10-25)11-12-30-24(33)22-20(27)15-29-16-21(22)28/h3-6,15-16,18H,2,7-14H2,1H3,(H,30,33)/b31-23- | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.14E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Genzyme Corp.
Curated by ChEMBL
| Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells |
Bioorg Med Chem Lett 21: 2450-5 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3 |
More data for this
Ligand-Target Pair | |
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