Found 41 hits with Last Name = 'spengler' and Initial = 'g' 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 |
|---|
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50520922
(CHEMBL4547780)Show InChI InChI=1S/C20H25N3O2/c1-17(24)18-3-5-20(6-4-18)25-16-2-11-22-12-14-23(15-13-22)19-7-9-21-10-8-19/h3-10H,2,11-16H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| Article
PubMed
| 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Binding affinity to at human H3 receptor |
Citation and Details
Article DOI: 10.1016/j.bmcl.2020.127522
BindingDB Entry DOI: 10.7270/Q29K4FVC |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50520924
(CHEMBL4581913)Show InChI InChI=1S/C20H25N3O2/c1-17(24)18-6-8-19(9-7-18)25-16-4-11-22-12-14-23(15-13-22)20-5-2-3-10-21-20/h2-3,5-10H,4,11-16H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 315 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Binding affinity to at human H3 receptor |
Citation and Details
Article DOI: 10.1016/j.bmcl.2020.127522
BindingDB Entry DOI: 10.7270/Q29K4FVC |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50405909
(CHEMBL4170784)Show InChI InChI=1S/C23H32O3S/c24-23(25)13-7-2-1-6-12-19-20(22-15-14-21(19)26-22)17-27-16-8-11-18-9-4-3-5-10-18/h1,3-6,9-10,19-22H,2,7-8,11-17H2,(H,24,25)/b6-1- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 683 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Binding affinity to at human H3 receptor |
Citation and Details
Article DOI: 10.1016/j.bmcl.2020.127522
BindingDB Entry DOI: 10.7270/Q29K4FVC |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50405708
(CHEMBL4166945)Show InChI InChI=1S/C15H19NO3S/c1-10(9-20)14(17)16-8-12(7-13(16)15(18)19)11-5-3-2-4-6-11/h2-6,10,12-13,20H,7-9H2,1H3,(H,18,19)/t10-,12+,13+/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 883 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Binding affinity to at human H3 receptor |
Citation and Details
Article DOI: 10.1016/j.bmcl.2020.127522
BindingDB Entry DOI: 10.7270/Q29K4FVC |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50520935
(CHEMBL4473431)Show InChI InChI=1S/C21H27N3O2/c1-18(25)19-6-8-21(9-7-19)26-16-3-2-11-23-12-14-24(15-13-23)20-5-4-10-22-17-20/h4-10,17H,2-3,11-16H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 908 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Binding affinity to at human H3 receptor |
Citation and Details
Article DOI: 10.1016/j.bmcl.2020.127522
BindingDB Entry DOI: 10.7270/Q29K4FVC |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50520933
(CHEMBL4467220)Show InChI InChI=1S/C20H26N4O2/c1-17(25)18-5-7-19(8-6-18)26-16-3-2-11-23-12-14-24(15-13-23)20-21-9-4-10-22-20/h4-10H,2-3,11-16H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 1.23E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Binding affinity to at human H3 receptor |
Citation and Details
Article DOI: 10.1016/j.bmcl.2020.127522
BindingDB Entry DOI: 10.7270/Q29K4FVC |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50520937
(CHEMBL4445569)Show InChI InChI=1S/C20H26N4O2/c1-2-19(25)17-4-6-18(7-5-17)26-15-3-10-23-11-13-24(14-12-23)20-16-21-8-9-22-20/h4-9,16H,2-3,10-15H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 1.72E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Binding affinity to at human H3 receptor |
Citation and Details
Article DOI: 10.1016/j.bmcl.2020.127522
BindingDB Entry DOI: 10.7270/Q29K4FVC |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50405908
(CHEMBL4162840)Show InChI InChI=1S/C18H30O3S/c1-2-3-12-22-13-15-14(16-10-11-17(15)21-16)8-6-4-5-7-9-18(19)20/h4,6,14-17H,2-3,5,7-13H2,1H3,(H,19,20)/b6-4- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.26E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Binding affinity to at human H3 receptor |
Citation and Details
Article DOI: 10.1016/j.bmcl.2020.127522
BindingDB Entry DOI: 10.7270/Q29K4FVC |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50520941
(CHEMBL4519189)Show InChI InChI=1S/C19H24N4O2/c1-16(24)17-4-6-18(7-5-17)25-15-3-10-22-11-13-23(14-12-22)19-20-8-2-9-21-19/h2,4-9H,3,10-15H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 2.32E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Binding affinity to at human H3 receptor |
Citation and Details
Article DOI: 10.1016/j.bmcl.2020.127522
BindingDB Entry DOI: 10.7270/Q29K4FVC |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50405707
(CHEMBL4163913)Show InChI InChI=1S/C15H19NO4S/c1-10(9-21)14(17)16-8-12(7-13(16)15(18)19)20-11-5-3-2-4-6-11/h2-6,10,12-13,21H,7-9H2,1H3,(H,18,19)/t10-,12+,13+/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.96E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Binding affinity to at human H3 receptor |
Citation and Details
Article DOI: 10.1016/j.bmcl.2020.127522
BindingDB Entry DOI: 10.7270/Q29K4FVC |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50520934
(CHEMBL4453108)Show InChI InChI=1S/C20H26N4O2/c1-2-19(25)17-5-7-18(8-6-17)26-16-4-11-23-12-14-24(15-13-23)20-21-9-3-10-22-20/h3,5-10H,2,4,11-16H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 3.39E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Binding affinity to at human H3 receptor |
Citation and Details
Article DOI: 10.1016/j.bmcl.2020.127522
BindingDB Entry DOI: 10.7270/Q29K4FVC |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50405734
(CHEMBL4170350)Show InChI InChI=1S/C17H30N7O3S/c1-28(10(4-6-19)3-2-5-18)7-11-13(25)14(26)17(27-11)24-9-23-12-15(20)21-8-22-16(12)24/h8-11,13-14,17,25-26H,2-7,18-19H2,1H3,(H2,20,21,22)/q+1/t10?,11-,13?,14?,17?,28?/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.42E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Binding affinity to at human H3 receptor |
Citation and Details
Article DOI: 10.1016/j.bmcl.2020.127522
BindingDB Entry DOI: 10.7270/Q29K4FVC |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50520940
(CHEMBL4452580)Show InChI InChI=1S/C21H27N3O2/c1-18(25)19-7-9-20(10-8-19)26-17-5-4-12-23-13-15-24(16-14-23)21-6-2-3-11-22-21/h2-3,6-11H,4-5,12-17H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 3.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Binding affinity to at human H3 receptor |
Citation and Details
Article DOI: 10.1016/j.bmcl.2020.127522
BindingDB Entry DOI: 10.7270/Q29K4FVC |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50405712
(CHEMBL4166262)Show InChI InChI=1S/C9H13NO4S/c1-5(4-15)8(12)10-3-6(11)2-7(10)9(13)14/h5,7,15H,2-4H2,1H3,(H,13,14)/t5-,7+/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 3.83E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Binding affinity to at human H3 receptor |
Citation and Details
Article DOI: 10.1016/j.bmcl.2020.127522
BindingDB Entry DOI: 10.7270/Q29K4FVC |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50405702
(CHEMBL4159046)Show InChI InChI=1S/C15H18FNO3S2/c1-9(8-21)14(18)17-7-12(6-13(17)15(19)20)22-11-4-2-10(16)3-5-11/h2-5,9,12-13,21H,6-8H2,1H3,(H,19,20)/t9-,12+,13+/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.48E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Binding affinity to at human H3 receptor |
Citation and Details
Article DOI: 10.1016/j.bmcl.2020.127522
BindingDB Entry DOI: 10.7270/Q29K4FVC |
More data for this
Ligand-Target Pair | |
Histamine H3 receptor
(Homo sapiens (Human)) | BDBM50405703
(CHEMBL4171151)Show InChI InChI=1S/C19H26N2O5S/c1-12(17(22)21-11-14(27-2)10-16(21)19(25)26)20-15(18(23)24)9-8-13-6-4-3-5-7-13/h3-7,12,14-16,20H,8-11H2,1-2H3,(H,23,24)(H,25,26)/t12-,14+,15-,16-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Binding affinity to at human H3 receptor |
Citation and Details
Article DOI: 10.1016/j.bmcl.2020.127522
BindingDB Entry DOI: 10.7270/Q29K4FVC |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235446
(CHEMBL4081538)Show SMILES [H][C@]12C\C(=N/O)c3[nH]c4ccccc4c3C[C@@]([H])([C@H]1C(=O)OC)N(C)C[C@@H]2CC |r| Show InChI InChI=1S/C21H27N3O3/c1-4-12-11-24(2)18-10-15-13-7-5-6-8-16(13)22-20(15)17(23-26)9-14(12)19(18)21(25)27-3/h5-8,12,14,18-19,22,26H,4,9-11H2,1-3H3/b23-17+/t12-,14+,18-,19-/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.67E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of human ABCB1 expressed in mouse L5178Y cells assessed as reduction in cell growth after 24 hrs by MTT assay |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235424
(CHEMBL3605260)Show SMILES [H][C@@]12C\C(=N/Nc3ccccc3)c3[nH]c4ccccc4c3C[C@]([H])(N(C)C[C@H]1CC)[C@@]2([H])C(=O)OC |r| Show InChI InChI=1S/C27H32N4O2/c1-4-17-16-31(2)24-15-21-19-12-8-9-13-22(19)28-26(21)23(14-20(17)25(24)27(32)33-3)30-29-18-10-6-5-7-11-18/h5-13,17,20,24-25,28-29H,4,14-16H2,1-3H3/b30-23+/t17-,20-,24+,25+/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD
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 |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of human ABCB1 expressed in mouse L5178Y cells assessed as reduction in cell growth after 24 hrs by MTT assay |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235445
(CHEMBL3605262)Show SMILES [H][C@@]12C\C(=N/Nc3ccc(Br)cn3)c3[nH]c4ccccc4c3C[C@]([H])(N(C)C[C@H]1CC)[C@@]2([H])C(=O)OC |r| Show InChI InChI=1S/C26H30BrN5O2/c1-4-15-14-32(2)22-12-19-17-7-5-6-8-20(17)29-25(19)21(11-18(15)24(22)26(33)34-3)30-31-23-10-9-16(27)13-28-23/h5-10,13,15,18,22,24,29H,4,11-12,14H2,1-3H3,(H,28,31)/b30-21+/t15-,18-,22+,24+/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3.76E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of human ABCB1 expressed in mouse L5178Y cells assessed as reduction in cell growth after 24 hrs by MTT assay |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235438
(CHEMBL4060246)Show SMILES [H][C@]12CC(=O)c3c(C[C@@]([H])([C@H]1C(=O)OC)N(C)C[C@@H]2CC)c1ccccc1n3Cc1ccccc1 |r| Show InChI InChI=1S/C28H32N2O3/c1-4-19-17-29(2)24-14-22-20-12-8-9-13-23(20)30(16-18-10-6-5-7-11-18)27(22)25(31)15-21(19)26(24)28(32)33-3/h5-13,19,21,24,26H,4,14-17H2,1-3H3/t19-,21+,24-,26-/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3.81E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of human ABCB1 expressed in mouse L5178Y cells assessed as reduction in cell growth after 24 hrs by MTT assay |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235444
(CHEMBL3605261)Show SMILES [H][C@@]12C\C(=N/Nc3ccc(Br)cn3)c3[nH]c4ccccc4c3C[C@]([H])(N(C)C[C@@H]1CC)[C@@]2([H])C(=O)OC |r| Show InChI InChI=1S/C26H30BrN5O2/c1-4-15-14-32(2)22-12-19-17-7-5-6-8-20(17)29-25(19)21(11-18(15)24(22)26(33)34-3)30-31-23-10-9-16(27)13-28-23/h5-10,13,15,18,22,24,29H,4,11-12,14H2,1-3H3,(H,28,31)/b30-21+/t15-,18+,22-,24-/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3.99E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of binding of [125I]-PD 142308 to CCK-B receptor was determined |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235431
(CHEMBL4101435)Show SMILES [H][C@]12C\C(=N/NC(=S)NCc3cccnc3)c3[nH]c4ccccc4c3C[C@@]([H])([C@H]1C(=O)OC)N(C)C[C@@H]2CC |r| Show InChI InChI=1S/C28H34N6O2S/c1-4-18-16-34(2)24-13-21-19-9-5-6-10-22(19)31-26(21)23(12-20(18)25(24)27(35)36-3)32-33-28(37)30-15-17-8-7-11-29-14-17/h5-11,14,18,20,24-25,31H,4,12-13,15-16H2,1-3H3,(H2,30,33,37)/b32-23+/t18-,20+,24-,25-/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 4.52E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of human ABCB1 expressed in mouse L5178Y cells assessed as reduction in cell growth after 24 hrs by MTT assay |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235442
(CHEMBL4076299)Show SMILES [H][C@]12C\C(=N/N)c3[nH]c4ccccc4c3C[C@@]([H])([C@H]1C(=O)OC)N(C)C[C@H]2CC |r| Show InChI InChI=1S/C21H28N4O2/c1-4-12-11-25(2)18-10-15-13-7-5-6-8-16(13)23-20(15)17(24-22)9-14(12)19(18)21(26)27-3/h5-8,12,14,18-19,23H,4,9-11,22H2,1-3H3/b24-17+/t12-,14-,18+,19+/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
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| Article
PubMed
| n/a | n/a | 4.87E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of human ABCB1 expressed in mouse L5178Y cells assessed as reduction in cell growth after 24 hrs by MTT assay |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235430
(CHEMBL4074751)Show SMILES [H][C@]12C\C(=N/NC(=O)OCc3ccc(OC)cc3)c3[nH]c4ccccc4c3C[C@@]([H])([C@H]1C(=O)OC)N(C)C[C@@H]2CC |r| Show InChI InChI=1S/C30H36N4O5/c1-5-19-16-34(2)26-15-23-21-8-6-7-9-24(21)31-28(23)25(14-22(19)27(26)29(35)38-4)32-33-30(36)39-17-18-10-12-20(37-3)13-11-18/h6-13,19,22,26-27,31H,5,14-17H2,1-4H3,(H,33,36)/b32-25+/t19-,22+,26-,27-/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 5.23E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of human ABCB1 expressed in mouse L5178Y cells assessed as reduction in cell growth after 24 hrs by MTT assay |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235449
(CHEMBL3605259)Show SMILES [H][C@@]12C\C(=N/Nc3ccccc3)c3[nH]c4ccccc4c3C[C@]([H])(N(C)C[C@@H]1CC)[C@@]2([H])C(=O)OC |r| Show InChI InChI=1S/C27H32N4O2/c1-4-17-16-31(2)24-15-21-19-12-8-9-13-22(19)28-26(21)23(14-20(17)25(24)27(32)33-3)30-29-18-10-6-5-7-11-18/h5-13,17,20,24-25,28-29H,4,14-16H2,1-3H3/b30-23+/t17-,20+,24-,25-/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 5.27E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of human ABCB1 expressed in mouse L5178Y cells assessed as reduction in cell growth after 24 hrs by MTT assay |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235440
(CHEMBL4074765)Show SMILES [H][C@]12C\C(=N/N)c3[nH]c4ccccc4c3C[C@@]([H])([C@H]1C(=O)OC)N(C)C[C@@H]2CC |r| Show InChI InChI=1S/C21H28N4O2/c1-4-12-11-25(2)18-10-15-13-7-5-6-8-16(13)23-20(15)17(24-22)9-14(12)19(18)21(26)27-3/h5-8,12,14,18-19,23H,4,9-11,22H2,1-3H3/b24-17+/t12-,14+,18-,19-/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.34E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of human ABCB1 expressed in mouse L5178Y cells assessed as reduction in cell growth after 24 hrs by MTT assay |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235432
(CHEMBL4083129)Show SMILES [H][C@]12CC(=S)c3[nH]c4ccccc4c3C[C@@]([H])([C@H]1C(=O)OC)N(C)C[C@@H]2CC |r| Show InChI InChI=1S/C21H26N2O2S/c1-4-12-11-23(2)17-9-15-13-7-5-6-8-16(13)22-20(15)18(26)10-14(12)19(17)21(24)25-3/h5-8,12,14,17,19,22H,4,9-11H2,1-3H3/t12-,14+,17-,19-/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 7.79E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of human ABCB1 expressed in mouse L5178Y cells assessed as reduction in cell growth after 24 hrs by MTT assay |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235434
(CHEMBL4090917)Show SMILES [H][C@]12C[C@H](O)c3[nH]c4ccccc4c3C[C@@]([H])([C@H]1C(=O)OC)N(C)C[C@H]2CC |r| Show InChI InChI=1S/C21H28N2O3/c1-4-12-11-23(2)17-9-15-13-7-5-6-8-16(13)22-20(15)18(24)10-14(12)19(17)21(25)26-3/h5-8,12,14,17-19,22,24H,4,9-11H2,1-3H3/t12-,14-,17+,18+,19+/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| n/a | n/a | 8.39E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of human ABCB1 expressed in mouse L5178Y cells assessed as reduction in cell growth after 24 hrs by MTT assay |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235425
(CHEMBL4062327)Show SMILES [H][C@]12C\C(=N/Nc3cnccn3)c3[nH]c4ccccc4c3C[C@@]([H])([C@H]1C(=O)OC)N(C)C[C@@H]2CC |r| Show InChI InChI=1S/C25H30N6O2/c1-4-15-14-31(2)21-12-18-16-7-5-6-8-19(16)28-24(18)20(11-17(15)23(21)25(32)33-3)29-30-22-13-26-9-10-27-22/h5-10,13,15,17,21,23,28H,4,11-12,14H2,1-3H3,(H,27,30)/b29-20+/t15-,17+,21-,23-/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8.48E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity (competitive) against alpha-L-fucosidase from bovine kidney |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235447
(CHEMBL4059582)Show SMILES [H][C@]12C\C(=N/O)c3[nH]c4ccccc4c3C[C@@]([H])([C@H]1C(=O)OC)N(C)C[C@H]2CC |r| Show InChI InChI=1S/C21H27N3O3/c1-4-12-11-24(2)18-10-15-13-7-5-6-8-16(13)22-20(15)17(23-26)9-14(12)19(18)21(25)27-3/h5-8,12,14,18-19,22,26H,4,9-11H2,1-3H3/b23-17+/t12-,14-,18+,19+/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 8.54E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of binding of [125I]-PD 142308 to CCK-B receptor was determined |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235437
(CHEMBL4071619)Show SMILES [H][C@]12CC(=O)c3c(C[C@@]([H])([C@H]1C(=O)OC)N(C)C[C@@H]2CC)c1ccccc1n3C |r| Show InChI InChI=1S/C22H28N2O3/c1-5-13-12-23(2)18-10-16-14-8-6-7-9-17(14)24(3)21(16)19(25)11-15(13)20(18)22(26)27-4/h6-9,13,15,18,20H,5,10-12H2,1-4H3/t13-,15+,18-,20-/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 8.92E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of human ABCB1 expressed in mouse L5178Y cells assessed as reduction in cell growth after 24 hrs by MTT assay |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235439
(CHEMBL4082147)Show SMILES [H][C@]12CC(=O)c3c(C[C@@]([H])([C@H]1C(=O)OC)N(C)C[C@@H]2CC)c1ccccc1n3CCN(CC)CC |r| Show InChI InChI=1S/C27H39N3O3/c1-6-18-17-28(4)23-15-21-19-11-9-10-12-22(19)30(14-13-29(7-2)8-3)26(21)24(31)16-20(18)25(23)27(32)33-5/h9-12,18,20,23,25H,6-8,13-17H2,1-5H3/t18-,20+,23-,25-/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of human ABCB1 expressed in mouse L5178Y cells assessed as reduction in cell growth after 24 hrs by MTT assay |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235448
(CHEMBL4070955)Show SMILES [H][C@]12C\C(=N/NC(N)=O)c3[nH]c4ccccc4c3C[C@@]([H])([C@H]1C(=O)OC)N(C)C[C@@H]2CC |r| Show InChI InChI=1S/C22H29N5O3/c1-4-12-11-27(2)18-10-15-13-7-5-6-8-16(13)24-20(15)17(25-26-22(23)29)9-14(12)19(18)21(28)30-3/h5-8,12,14,18-19,24H,4,9-11H2,1-3H3,(H3,23,26,29)/b25-17+/t12-,14+,18-,19-/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of human ABCB1 expressed in mouse L5178Y cells assessed as reduction in cell growth after 24 hrs by MTT assay |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235436
(CHEMBL4098642)Show SMILES [H][C@]12C[C@H](OC(=O)C34CC5CC(CC(C5)C3)C4)c3[nH]c4ccccc4c3C[C@@]([H])([C@H]1C(=O)OC)N(C)C[C@H]2CC |r,TLB:5:7:10:14.12.13,THB:12:11:8:14.13.15,12:13:10.11.16:8,15:13:10:16.7.8,15:7:10:14.12.13| Show InChI InChI=1S/C32H42N2O4/c1-4-21-17-34(2)26-12-24-22-7-5-6-8-25(22)33-29(24)27(13-23(21)28(26)30(35)37-3)38-31(36)32-14-18-9-19(15-32)11-20(10-18)16-32/h5-8,18-21,23,26-28,33H,4,9-17H2,1-3H3/t18?,19?,20?,21-,23-,26+,27+,28+,32?/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
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| Article
PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of human ABCB1 expressed in mouse L5178Y cells assessed as reduction in cell growth after 24 hrs by MTT assay |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235435
(CHEMBL4062990)Show SMILES [H][C@]12C[C@H](OC(=O)\C=C\C)c3[nH]c4ccccc4c3C[C@@]([H])([C@H]1C(=O)OC)N(C)C[C@@H]2CC |r| Show InChI InChI=1S/C25H32N2O4/c1-5-9-22(28)31-21-13-17-15(6-2)14-27(3)20(23(17)25(29)30-4)12-18-16-10-7-8-11-19(16)26-24(18)21/h5,7-11,15,17,20-21,23,26H,6,12-14H2,1-4H3/b9-5+/t15-,17+,20-,21-,23-/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of human ABCB1 expressed in mouse L5178Y cells assessed as reduction in cell growth after 24 hrs by MTT assay |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235428
(CHEMBL4090331)Show SMILES [H][C@]12C\C(=N/Nc3cnccn3)c3[nH]c4ccccc4c3C[C@@]([H])([C@H]1C(=O)OC)N(C)C[C@H]2CC |r| Show InChI InChI=1S/C25H30N6O2/c1-4-15-14-31(2)21-12-18-16-7-5-6-8-19(16)28-24(18)20(11-17(15)23(21)25(32)33-3)29-30-22-13-26-9-10-27-22/h5-10,13,15,17,21,23,28H,4,11-12,14H2,1-3H3,(H,27,30)/b29-20+/t15-,17-,21+,23+/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of human ABCB1 expressed in mouse L5178Y cells assessed as reduction in cell growth after 24 hrs by MTT assay |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235427
(CHEMBL4075029)Show SMILES [H][C@]12CC(=O)c3[nH]c4ccccc4c3C[C@@]([H])([C@H]1C(=O)OC)N(C)C[C@H]2CC |r| Show InChI InChI=1S/C21H26N2O3/c1-4-12-11-23(2)17-9-15-13-7-5-6-8-16(13)22-20(15)18(24)10-14(12)19(17)21(25)26-3/h5-8,12,14,17,19,22H,4,9-11H2,1-3H3/t12-,14-,17+,19+/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of human ABCB1 expressed in mouse L5178Y cells assessed as reduction in cell growth after 24 hrs by MTT assay |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235426
(CHEMBL3358048)Show SMILES [H][C@]12CC(=O)c3[nH]c4ccccc4c3C[C@@]([H])([C@H]1C(=O)OC)N(C)C[C@@H]2CC |r| Show InChI InChI=1S/C21H26N2O3/c1-4-12-11-23(2)17-9-15-13-7-5-6-8-16(13)22-20(15)18(24)10-14(12)19(17)21(25)26-3/h5-8,12,14,17,19,22H,4,9-11H2,1-3H3/t12-,14+,17-,19-/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of human ABCB1 expressed in mouse L5178Y cells assessed as reduction in cell growth after 24 hrs by MTT assay |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235443
(CHEMBL4094301)Show SMILES [H][C@]12CC(=O)c3c(C[C@@]([H])([C@H]1C(=O)OC)N(C)C[C@@H]2CC)c1ccccc1n3C(=O)c1cccc(C)c1 |r| Show InChI InChI=1S/C29H32N2O4/c1-5-18-16-30(3)24-14-22-20-11-6-7-12-23(20)31(28(33)19-10-8-9-17(2)13-19)27(22)25(32)15-21(18)26(24)29(34)35-4/h6-13,18,21,24,26H,5,14-16H2,1-4H3/t18-,21+,24-,26-/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of human ABCB1 expressed in mouse L5178Y cells assessed as reduction in cell growth after 24 hrs by MTT assay |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235433
(CHEMBL4101113)Show SMILES [H][C@]12C[C@H](O)c3[nH]c4ccccc4c3C[C@@]([H])([C@H]1C(=O)OC)N(C)C[C@@H]2CC |r| Show InChI InChI=1S/C21H28N2O3/c1-4-12-11-23(2)17-9-15-13-7-5-6-8-16(13)22-20(15)18(24)10-14(12)19(17)21(25)26-3/h5-8,12,14,17-19,22,24H,4,9-11H2,1-3H3/t12-,14+,17-,18-,19-/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of human ABCB1 expressed in mouse L5178Y cells assessed as reduction in cell growth after 24 hrs by MTT assay |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
ATP-dependent translocase ABCB1
(Homo sapiens (Human)) | BDBM50235429
(CHEMBL4098041)Show SMILES [H][C@]12C\C(=N/NC(N)=O)c3[nH]c4ccccc4c3C[C@@]([H])([C@H]1C(=O)OC)N(C)C[C@H]2CC |r| Show InChI InChI=1S/C22H29N5O3/c1-4-12-11-27(2)18-10-15-13-7-5-6-8-16(13)24-20(15)17(25-26-22(23)29)9-14(12)19(18)21(28)30-3/h5-8,12,14,18-19,24H,4,9-11H2,1-3H3,(H3,23,26,29)/b25-17+/t12-,14-,18+,19+/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade de Lisboa
Curated by ChEMBL
| Assay Description
Inhibition of human ABCB1 expressed in mouse L5178Y cells assessed as reduction in cell growth after 24 hrs by MTT assay |
Eur J Med Chem 128: 247-257 (2017)
Article DOI: 10.1016/j.ejmech.2017.01.044
BindingDB Entry DOI: 10.7270/Q2BV7JVT |
More data for this
Ligand-Target Pair | |
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