Found 670 hits with Last Name = 'camac' and Initial = 'dm' 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 |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50507371
(BMS-823778)Show InChI InChI=1S/C18H18ClN3O/c1-17(2,23)14-4-3-11-22-15(14)20-21-16(22)18(9-10-18)12-5-7-13(19)8-6-12/h3-8,11,23H,9-10H2,1-2H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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MCE PC cid PC sid PDB UniChem
| PDB Article PubMed
| 0.900 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb
Curated by ChEMBL
| Assay Description Inhibition of recombinant human 11beta-HSD1 expressed in HEK293 cell microsomes using [3H]cortisone as substrate after 4 hrs by homogeneous immuno-ra... |
ACS Med Chem Lett 9: 1170-1174 (2018)
Article DOI: 10.1021/acsmedchemlett.8b00307 BindingDB Entry DOI: 10.7270/Q20R9SP3 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50239606
(CHEMBL4080667)Show SMILES OC1CN(C1)C(=O)CC1(C2CC3CC1CC(C2)[C@H]3O)c1ccccc1 |r,wD:17.21,TLB:16:15:8.9.10:12,7:8:14.16.15:10.11.12,7:8:12:14.15.17,THB:16:9:12:14.15.17,18:17:8.9.10:12,17:15:8:10.11.12,17:11:8:14.16.15,19:8:14.16.15:10.11.12,19:8:12:14.15.17,(43.24,-21.55,;43.72,-20.08,;43.03,-18.71,;44.4,-18.01,;45.1,-19.38,;44.88,-16.54,;43.63,-15.64,;46.35,-16.07,;47.49,-17.11,;48.99,-16.68,;48.98,-15.1,;50.02,-13.87,;48.67,-14.34,;48.68,-15.83,;50,-16.32,;51.4,-15.97,;50.4,-17.25,;51.42,-14.44,;52.71,-13.59,;47.48,-18.64,;46.13,-19.39,;46.12,-20.93,;47.44,-21.71,;48.79,-20.95,;48.79,-19.41,)| Show InChI InChI=1S/C21H27NO3/c23-18-11-22(12-18)19(24)10-21(15-4-2-1-3-5-15)16-6-13-7-17(21)9-14(8-16)20(13)25/h1-5,13-14,16-18,20,23,25H,6-12H2/t13?,14?,16?,17?,20-,21? | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 3.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human microsomes using [3H]cortisone as substrate preincubated for 10 mins followed by substrate addition measured after... |
J Med Chem 60: 4932-4948 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00211 BindingDB Entry DOI: 10.7270/Q2DV1N23 |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398864
(CHEMBL2178164)Show SMILES COc1ccc(cc1)-c1nsc(C)c1C(=O)NC(N)=NCc1cc(Cl)c(NC(=O)CN2CCC2)c(Cl)c1 |w:19.21| Show InChI InChI=1S/C25H26Cl2N6O3S/c1-14-21(22(32-37-14)16-4-6-17(36-2)7-5-16)24(35)31-25(28)29-12-15-10-18(26)23(19(27)11-15)30-20(34)13-33-8-3-9-33/h4-7,10-11H,3,8-9,12-13H2,1-2H3,(H,30,34)(H3,28,29,31,35) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398882
(CHEMBL2178180)Show SMILES COc1ccc(cc1)-c1nsc(C)c1C(=O)NC(N)=NCc1cc(Cl)c(NC(C)=O)c(Cl)c1 |w:19.21| Show InChI InChI=1S/C22H21Cl2N5O3S/c1-11-18(19(29-33-11)14-4-6-15(32-3)7-5-14)21(31)28-22(25)26-10-13-8-16(23)20(17(24)9-13)27-12(2)30/h4-9H,10H2,1-3H3,(H,27,30)(H3,25,26,28,31) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398863
(CHEMBL2178165)Show SMILES COc1ccc(cc1)-c1nsc(C)c1C(=O)NC(N)=NCc1cc(C)c(NC(=O)CN2CCC2)c(Cl)c1 |w:19.21| Show InChI InChI=1S/C26H29ClN6O3S/c1-15-11-17(12-20(27)23(15)30-21(34)14-33-9-4-10-33)13-29-26(28)31-25(35)22-16(2)37-32-24(22)18-5-7-19(36-3)8-6-18/h5-8,11-12H,4,9-10,13-14H2,1-3H3,(H,30,34)(H3,28,29,31,35) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398868
(CHEMBL2178195)Show SMILES COc1ccc(cc1)-c1nsc(C)c1C(=O)NC(N)=NCc1cc(Cl)c(NC(=O)CNCc2ccccc2)c(Cl)c1 |w:19.21| Show InChI InChI=1S/C29H28Cl2N6O3S/c1-17-25(26(37-41-17)20-8-10-21(40-2)11-9-20)28(39)36-29(32)34-15-19-12-22(30)27(23(31)13-19)35-24(38)16-33-14-18-6-4-3-5-7-18/h3-13,33H,14-16H2,1-2H3,(H,35,38)(H3,32,34,36,39) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398866
(CHEMBL2178162)Show SMILES CCNCC(=O)Nc1c(Cl)cc(CN=C(N)NC(=O)c2c(C)snc2-c2ccc(OC)cc2)cc1Cl |w:13.12| Show InChI InChI=1S/C24H26Cl2N6O3S/c1-4-28-12-19(33)30-22-17(25)9-14(10-18(22)26)11-29-24(27)31-23(34)20-13(2)36-32-21(20)15-5-7-16(35-3)8-6-15/h5-10,28H,4,11-12H2,1-3H3,(H,30,33)(H3,27,29,31,34) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398867
(CHEMBL2178161)Show SMILES COc1ccc(cc1)-c1nsc(C)c1C(=O)NC(N)=NCc1cc(C)c(NC(=O)CNCc2ccccc2)c(Cl)c1 |w:19.21| Show InChI InChI=1S/C30H31ClN6O3S/c1-18-13-21(14-24(31)27(18)35-25(38)17-33-15-20-7-5-4-6-8-20)16-34-30(32)36-29(39)26-19(2)41-37-28(26)22-9-11-23(40-3)12-10-22/h4-14,33H,15-17H2,1-3H3,(H,35,38)(H3,32,34,36,39) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398883
(CHEMBL2178179)Show SMILES COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1cc(Cl)c(NC(C)=O)c(Cl)c1 |w:19.21| Show InChI InChI=1S/C22H21Cl2N5O4/c1-11-18(19(29-33-11)14-4-6-15(32-3)7-5-14)21(31)28-22(25)26-10-13-8-16(23)20(17(24)9-13)27-12(2)30/h4-9H,10H2,1-3H3,(H,27,30)(H3,25,26,28,31) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398874
(CHEMBL2178189)Show SMILES COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1cc(C)c(NC(=O)C2CC2)c(Cl)c1 |w:19.21| Show InChI InChI=1S/C25H26ClN5O4/c1-13-10-15(11-19(26)21(13)29-23(32)17-4-5-17)12-28-25(27)30-24(33)20-14(2)35-31-22(20)16-6-8-18(34-3)9-7-16/h6-11,17H,4-5,12H2,1-3H3,(H,29,32)(H3,27,28,30,33) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398870
(CHEMBL2178193)Show SMILES COc1ccc(cc1)-c1nsc(C)c1C(=O)NC(N)=NCc1cc(Cl)c(NC(=O)CN(C)C)c(Cl)c1 |w:19.21| Show InChI InChI=1S/C24H26Cl2N6O3S/c1-13-20(21(31-36-13)15-5-7-16(35-4)8-6-15)23(34)30-24(27)28-11-14-9-17(25)22(18(26)10-14)29-19(33)12-32(2)3/h5-10H,11-12H2,1-4H3,(H,29,33)(H3,27,28,30,34) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398869
(CHEMBL2178194)Show SMILES COc1ccc(cc1)-c1nsc(C)c1C(=O)NC(N)=NCc1cc(C)c(NC(=O)CN(C)C)c(Cl)c1 |w:19.21| Show InChI InChI=1S/C25H29ClN6O3S/c1-14-10-16(11-19(26)22(14)29-20(33)13-32(3)4)12-28-25(27)30-24(34)21-15(2)36-31-23(21)17-6-8-18(35-5)9-7-17/h6-11H,12-13H2,1-5H3,(H,29,33)(H3,27,28,30,34) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398881
(CHEMBL2178181)Show SMILES COc1ccc(cc1)-c1nsc(C)c1C(=O)NC(N)=NCc1cc(C)c(NC(C)=O)c(Cl)c1 |w:19.21| Show InChI InChI=1S/C23H24ClN5O3S/c1-12-9-15(10-18(24)20(12)27-14(3)30)11-26-23(25)28-22(31)19-13(2)33-29-21(19)16-5-7-17(32-4)8-6-16/h5-10H,11H2,1-4H3,(H,27,30)(H3,25,26,28,31) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL MMDB PC cid PC sid UniChem
Similars
| Article PubMed
| 20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398865
(CHEMBL2178163)Show SMILES CCNCC(=O)Nc1c(C)cc(CN=C(N)NC(=O)c2c(C)snc2-c2ccc(OC)cc2)cc1Cl |w:13.12| Show InChI InChI=1S/C25H29ClN6O3S/c1-5-28-13-20(33)30-22-14(2)10-16(11-19(22)26)12-29-25(27)31-24(34)21-15(3)36-32-23(21)17-6-8-18(35-4)9-7-17/h6-11,28H,5,12-13H2,1-4H3,(H,30,33)(H3,27,29,31,34) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398877
(CHEMBL2178186)Show SMILES COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1cc(C)c(NC(=O)CCSC)c(Cl)c1 |w:19.21| Show InChI InChI=1S/C25H28ClN5O4S/c1-14-11-16(12-19(26)22(14)29-20(32)9-10-36-4)13-28-25(27)30-24(33)21-15(2)35-31-23(21)17-5-7-18(34-3)8-6-17/h5-8,11-12H,9-10,13H2,1-4H3,(H,29,32)(H3,27,28,30,33) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398879
(CHEMBL2178184)Show SMILES COc1ccc(cc1)-c1nsc(C)c1C(=O)NC(N)=NCc1cc(C)c(NC(=O)c2ccccc2)c(Cl)c1 |w:19.21| Show InChI InChI=1S/C28H26ClN5O3S/c1-16-13-18(14-22(29)24(16)32-26(35)20-7-5-4-6-8-20)15-31-28(30)33-27(36)23-17(2)38-34-25(23)19-9-11-21(37-3)12-10-19/h4-14H,15H2,1-3H3,(H,32,35)(H3,30,31,33,36) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398876
(CHEMBL2178187)Show SMILES COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1cc(Cl)c(NC(=O)CS(C)(=O)=O)c(Cl)c1 |w:19.21| Show InChI InChI=1S/C23H23Cl2N5O6S/c1-12-19(20(30-36-12)14-4-6-15(35-2)7-5-14)22(32)29-23(26)27-10-13-8-16(24)21(17(25)9-13)28-18(31)11-37(3,33)34/h4-9H,10-11H2,1-3H3,(H,28,31)(H3,26,27,29,32) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398880
(CHEMBL2178183)Show SMILES CCC(=O)Nc1c(C)cc(CN=C(N)NC(=O)c2c(C)onc2-c2ccc(OC)cc2)cc1Cl |w:11.10| Show InChI InChI=1S/C24H26ClN5O4/c1-5-19(31)28-21-13(2)10-15(11-18(21)25)12-27-24(26)29-23(32)20-14(3)34-30-22(20)16-6-8-17(33-4)9-7-16/h6-11H,5,12H2,1-4H3,(H,28,31)(H3,26,27,29,32) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398884
(CHEMBL2178178)Show SMILES COc1ccc(cc1)-c1nsc(C)c1C(=O)NC(N)=NCc1cc(Cl)c(N)c(Cl)c1 |w:19.21| Show InChI InChI=1S/C20H19Cl2N5O2S/c1-10-16(18(27-30-10)12-3-5-13(29-2)6-4-12)19(28)26-20(24)25-9-11-7-14(21)17(23)15(22)8-11/h3-8H,9,23H2,1-2H3,(H3,24,25,26,28) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL MMDB PC cid PC sid UniChem
Similars
| Article PubMed
| 40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398871
(CHEMBL2178192)Show SMILES COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1cc(C)c(NC(=O)CN(C)C)c(Cl)c1 |w:19.21| Show InChI InChI=1S/C25H29ClN6O4/c1-14-10-16(11-19(26)22(14)29-20(33)13-32(3)4)12-28-25(27)30-24(34)21-15(2)36-31-23(21)17-6-8-18(35-5)9-7-17/h6-11H,12-13H2,1-5H3,(H,29,33)(H3,27,28,30,34) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 50 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398878
(CHEMBL2178185)Show SMILES COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1cc(Cl)c(NC(=O)CSC)c(Cl)c1 |w:19.21| Show InChI InChI=1S/C23H23Cl2N5O4S/c1-12-19(20(30-34-12)14-4-6-15(33-2)7-5-14)22(32)29-23(26)27-10-13-8-16(24)21(17(25)9-13)28-18(31)11-35-3/h4-9H,10-11H2,1-3H3,(H,28,31)(H3,26,27,29,32) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 50 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398872
(CHEMBL2178191)Show SMILES COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1cc(Cl)c(NC(=O)CN(C)C)c(Cl)c1 |w:19.21| Show InChI InChI=1S/C24H26Cl2N6O4/c1-13-20(21(31-36-13)15-5-7-16(35-4)8-6-15)23(34)30-24(27)28-11-14-9-17(25)22(18(26)10-14)29-19(33)12-32(2)3/h5-10H,11-12H2,1-4H3,(H,29,33)(H3,27,28,30,34) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 50 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398875
(CHEMBL2178188)Show SMILES COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1cc(Cl)c(NC(=O)C2CC2)c(Cl)c1 |w:19.21| Show InChI InChI=1S/C24H23Cl2N5O4/c1-12-19(20(31-35-12)14-5-7-16(34-2)8-6-14)23(33)30-24(27)28-11-13-9-17(25)21(18(26)10-13)29-22(32)15-3-4-15/h5-10,15H,3-4,11H2,1-2H3,(H,29,32)(H3,27,28,30,33) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 50 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398873
(CHEMBL2178190)Show SMILES COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1cc(C)c(NC(=O)c2ccco2)c(Cl)c1 |w:19.21| Show InChI InChI=1S/C26H24ClN5O5/c1-14-11-16(12-19(27)22(14)30-24(33)20-5-4-10-36-20)13-29-26(28)31-25(34)21-15(2)37-32-23(21)17-6-8-18(35-3)9-7-17/h4-12H,13H2,1-3H3,(H,30,33)(H3,28,29,31,34) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398888
(CHEMBL2178177)Show SMILES COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1cc(Cl)c(N)c(Cl)c1 |w:19.21| Show InChI InChI=1S/C20H19Cl2N5O3/c1-10-16(18(27-30-10)12-3-5-13(29-2)6-4-12)19(28)26-20(24)25-9-11-7-14(21)17(23)15(22)8-11/h3-8H,9,23H2,1-2H3,(H3,24,25,26,28) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 120 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398893
(CHEMBL2178172)Show SMILES COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1cc(Cl)cc(\C=C\CCO)c1 |w:19.21| Show InChI InChI=1S/C24H25ClN4O4/c1-15-21(22(29-33-15)18-6-8-20(32-2)9-7-18)23(31)28-24(26)27-14-17-11-16(5-3-4-10-30)12-19(25)13-17/h3,5-9,11-13,30H,4,10,14H2,1-2H3,(H3,26,27,28,31)/b5-3+ | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 140 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398891
(CHEMBL2178174)Show SMILES COC\C=C\c1cc(Cl)cc(CN=C(N)NC(=O)c2c(C)onc2-c2ccc(OC)cc2)c1 |w:12.11| Show InChI InChI=1S/C24H25ClN4O4/c1-15-21(22(29-33-15)18-6-8-20(32-3)9-7-18)23(30)28-24(26)27-14-17-11-16(5-4-10-31-2)12-19(25)13-17/h4-9,11-13H,10,14H2,1-3H3,(H3,26,27,28,30)/b5-4+ | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 150 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398902
(CHEMBL2178202)Show SMILES COc1ccc(cc1)-c1n[nH]c(C)c1C(=O)NC(N)=NCc1cc(Cl)cc(Cl)c1 |w:19.21| Show InChI InChI=1S/C20H19Cl2N5O2/c1-11-17(18(27-26-11)13-3-5-16(29-2)6-4-13)19(28)25-20(23)24-10-12-7-14(21)9-15(22)8-12/h3-9H,10H2,1-2H3,(H,26,27)(H3,23,24,25,28) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 210 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398898
(CHEMBL2178167)Show SMILES COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1cc(Cl)cc(Br)c1 |w:19.21| Show InChI InChI=1S/C20H18BrClN4O3/c1-11-17(18(26-29-11)13-3-5-16(28-2)6-4-13)19(27)25-20(23)24-10-12-7-14(21)9-15(22)8-12/h3-9H,10H2,1-2H3,(H3,23,24,25,27) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 270 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398887
(CHEMBL2178182)Show SMILES COc1ccc(cc1)-c1nsc(C)c1C(=O)NC(N)=NCc1cc(Cl)c(NS(C)(=O)=O)c(Cl)c1 |w:19.21| Show InChI InChI=1S/C21H21Cl2N5O4S2/c1-11-17(18(27-33-11)13-4-6-14(32-2)7-5-13)20(29)26-21(24)25-10-12-8-15(22)19(16(23)9-12)28-34(3,30)31/h4-9,28H,10H2,1-3H3,(H3,24,25,26,29) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 280 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398897
(CHEMBL2178168)Show SMILES COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1cc(C)cc(C)c1 |w:19.21| Show InChI InChI=1S/C22H24N4O3/c1-13-9-14(2)11-16(10-13)12-24-22(23)25-21(27)19-15(3)29-26-20(19)17-5-7-18(28-4)8-6-17/h5-11H,12H2,1-4H3,(H3,23,24,25,27) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 280 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398885
(CHEMBL2178204)Show SMILES COc1ccc(cc1)-c1nsc(C)c1C(=O)NC(N)=NCc1cc(Cl)cc(Cl)c1 |w:19.21| Show InChI InChI=1S/C20H18Cl2N4O2S/c1-11-17(18(26-29-11)13-3-5-16(28-2)6-4-13)19(27)25-20(23)24-10-12-7-14(21)9-15(22)8-12/h3-9H,10H2,1-2H3,(H3,23,24,25,27) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 290 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Mus musculus (mouse)) | BDBM50507371
(BMS-823778)Show InChI InChI=1S/C18H18ClN3O/c1-17(2,23)14-4-3-11-22-15(14)20-21-16(22)18(9-10-18)12-5-7-13(19)8-6-12/h3-8,11,23H,9-10H2,1-2H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| Purchase
MCE PC cid PC sid PDB UniChem
| PDB Article PubMed
| 380 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb
Curated by ChEMBL
| Assay Description Inhibition of recombinant mouse 11beta-HSD1 expressed in HEK293 cell microsomes using [3H]cortisone as substrate after 4 hrs by homogeneous immuno-ra... |
ACS Med Chem Lett 9: 1170-1174 (2018)
Article DOI: 10.1021/acsmedchemlett.8b00307 BindingDB Entry DOI: 10.7270/Q20R9SP3 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398894
(CHEMBL2178171)Show SMILES COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1cc(Cl)cc(C=C)c1 |w:19.21| Show InChI InChI=1S/C22H21ClN4O3/c1-4-14-9-15(11-17(23)10-14)12-25-22(24)26-21(28)19-13(2)30-27-20(19)16-5-7-18(29-3)8-6-16/h4-11H,1,12H2,2-3H3,(H3,24,25,26,28) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 430 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398890
(CHEMBL2178175)Show SMILES COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1cc(Cl)c(O)c(Cl)c1 |w:19.21| Show InChI InChI=1S/C20H18Cl2N4O4/c1-10-16(17(26-30-10)12-3-5-13(29-2)6-4-12)19(28)25-20(23)24-9-11-7-14(21)18(27)15(22)8-11/h3-8,27H,9H2,1-2H3,(H3,23,24,25,28) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 480 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398900
(CHEMBL2178205)Show SMILES COc1ccc(cc1)-c1nsc(C)c1C(=O)NC(N)=NCc1cccc2ccccc12 |w:19.21| Show InChI InChI=1S/C24H22N4O2S/c1-15-21(22(28-31-15)17-10-12-19(30-2)13-11-17)23(29)27-24(25)26-14-18-8-5-7-16-6-3-4-9-20(16)18/h3-13H,14H2,1-2H3,(H3,25,26,27,29) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 500 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398886
(CHEMBL2178200)Show SMILES COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1cc(Cl)cc(Cl)c1 |w:19.21| Show InChI InChI=1S/C20H18Cl2N4O3/c1-11-17(18(26-29-11)13-3-5-16(28-2)6-4-13)19(27)25-20(23)24-10-12-7-14(21)9-15(22)8-12/h3-9H,10H2,1-2H3,(H3,23,24,25,27) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 670 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398892
(CHEMBL2178173)Show SMILES CCC\C=C\c1cc(Cl)cc(CN=C(N)NC(=O)c2c(C)onc2-c2ccc(OC)cc2)c1 |w:12.11| Show InChI InChI=1S/C25H27ClN4O3/c1-4-5-6-7-17-12-18(14-20(26)13-17)15-28-25(27)29-24(31)22-16(2)33-30-23(22)19-8-10-21(32-3)11-9-19/h6-14H,4-5,15H2,1-3H3,(H3,27,28,29,31)/b7-6+ | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 850 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398903
(CHEMBL2178201)Show SMILES COc1ccc(cc1)-c1onc(C)c1C(=O)NC(N)=NCc1cc(Cl)cc(Cl)c1 |w:19.21| Show InChI InChI=1S/C20H18Cl2N4O3/c1-11-17(18(29-26-11)13-3-5-16(28-2)6-4-13)19(27)25-20(23)24-10-12-7-14(21)9-15(22)8-12/h3-9H,10H2,1-2H3,(H3,23,24,25,27) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 860 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398899
(CHEMBL2178166)Show SMILES COc1ccc(cc1)-c1nsc(C)c1C(=O)NC(N)=NCc1ccc2ccccc2c1 |w:19.21| Show InChI InChI=1S/C24H22N4O2S/c1-15-21(22(28-31-15)18-9-11-20(30-2)12-10-18)23(29)27-24(25)26-14-16-7-8-17-5-3-4-6-19(17)13-16/h3-13H,14H2,1-2H3,(H3,25,26,27,29) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 870 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398906
(CHEMBL2178197)Show SMILES COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1ccc(Cl)c(Cl)c1 |w:19.21| Show InChI InChI=1S/C20H18Cl2N4O3/c1-11-17(18(26-29-11)13-4-6-14(28-2)7-5-13)19(27)25-20(23)24-10-12-3-8-15(21)16(22)9-12/h3-9H,10H2,1-2H3,(H3,23,24,25,27) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 910 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398896
(CHEMBL2178169)Show SMILES COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1cc(Cl)cc(c1)-c1ccsc1 |w:19.21| Show InChI InChI=1S/C24H21ClN4O3S/c1-14-21(22(29-32-14)16-3-5-20(31-2)6-4-16)23(30)28-24(26)27-12-15-9-18(11-19(25)10-15)17-7-8-33-13-17/h3-11,13H,12H2,1-2H3,(H3,26,27,28,30) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 1.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398912
(CHEMBL2177116)Show SMILES COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1cccc2ccccc12 |w:19.21| Show InChI InChI=1S/C24H22N4O3/c1-15-21(22(28-31-15)17-10-12-19(30-2)13-11-17)23(29)27-24(25)26-14-18-8-5-7-16-6-3-4-9-20(16)18/h3-13H,14H2,1-2H3,(H3,25,26,27,29) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 1.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398913
(CHEMBL2178207)Show SMILES Cc1onc(c1C(=O)NC(N)=NCc1cccc2ccccc12)-c1ccc(F)cc1 |w:11.12| Show InChI InChI=1S/C23H19FN4O2/c1-14-20(21(28-30-14)16-9-11-18(24)12-10-16)22(29)27-23(25)26-13-17-7-4-6-15-5-2-3-8-19(15)17/h2-12H,13H2,1H3,(H3,25,26,27,29) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 1.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398895
(CHEMBL2178170)Show SMILES COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1cc(Cl)cc(c1)-c1cccnc1 |w:19.21| Show InChI InChI=1S/C25H22ClN5O3/c1-15-22(23(31-34-15)17-5-7-21(33-2)8-6-17)24(32)30-25(27)29-13-16-10-19(12-20(26)11-16)18-4-3-9-28-14-18/h3-12,14H,13H2,1-2H3,(H3,27,29,30,32) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 1.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398904
(CHEMBL2178199)Show SMILES Cc1onc(c1C(=O)NC(N)=NCc1cc(Cl)cc(Cl)c1)-c1ccc(F)cc1 |w:11.12| Show InChI InChI=1S/C19H15Cl2FN4O2/c1-10-16(17(26-28-10)12-2-4-15(22)5-3-12)18(27)25-19(23)24-9-11-6-13(20)8-14(21)7-11/h2-8H,9H2,1H3,(H3,23,24,25,27) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 2.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398907
(CHEMBL2178196)Show SMILES Cc1onc(c1C(=O)NC(N)=NCc1ccc(Cl)c(Cl)c1)-c1ccc(F)cc1 |w:11.12| Show InChI InChI=1S/C19H15Cl2FN4O2/c1-10-16(17(26-28-10)12-3-5-13(22)6-4-12)18(27)25-19(23)24-9-11-2-7-14(20)15(21)8-11/h2-8H,9H2,1H3,(H3,23,24,25,27) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 2.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398914
(CHEMBL2178206)Show SMILES Cc1onc(c1C(=O)NC(N)=NCc1cccc2ccccc12)-c1ccccc1 |w:11.12| Show InChI InChI=1S/C23H20N4O2/c1-15-20(21(27-29-15)17-9-3-2-4-10-17)22(28)26-23(24)25-14-18-12-7-11-16-8-5-6-13-19(16)18/h2-13H,14H2,1H3,(H3,24,25,26,28) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 2.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398905
(CHEMBL2178198)Show SMILES Cc1onc(c1C(=O)NC(N)=NCc1cc(Cl)cc(Cl)c1)-c1ccccc1 |w:11.12| Show InChI InChI=1S/C19H16Cl2N4O2/c1-11-16(17(25-27-11)13-5-3-2-4-6-13)18(26)24-19(22)23-10-12-7-14(20)9-15(21)8-12/h2-9H,10H2,1H3,(H3,22,23,24,26) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 3.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50398909
(CHEMBL2178751)Show SMILES COc1ccc(cc1)-c1noc(C)c1C(=O)NC(N)=NCc1ccccc1 |w:19.21| Show InChI InChI=1S/C20H20N4O3/c1-13-17(18(24-27-13)15-8-10-16(26-2)11-9-15)19(25)23-20(21)22-12-14-6-4-3-5-7-14/h3-11H,12H2,1-2H3,(H3,21,22,23,25) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Research
Curated by ChEMBL
| Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells |
J Med Chem 55: 9208-23 (2012)
Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M |
More data for this Ligand-Target Pair | |