Found 13762 hits with Last Name = 'campbell' and Initial = 't' 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 |
|---|
RAC-alpha serine/threonine-protein kinase [139-480,S378A,S381A,T450D,S473D]
(Homo sapiens (Human)) | BDBM15131
(5-indazolyl pyridine 3 | 5-{5-[(2S)-2-amino-3-(1H-...)Show SMILES Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c1 |r| Show InChI InChI=1S/C24H23N5O/c1-15-22-10-16(6-7-24(22)29-28-15)17-9-20(13-26-11-17)30-14-19(25)8-18-12-27-23-5-3-2-4-21(18)23/h2-7,9-13,19,27H,8,14,25H2,1H3,(H,28,29)/t19-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet 
| Purchase
DrugBank
MCE
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 0.160 | n/a | n/a | n/a | n/a | 7.5 | 22 |
Abbott Laboratories
| Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat... |
J Med Chem 50: 2990-3003 (2007)
Article DOI: 10.1021/jm0701019
BindingDB Entry DOI: 10.7270/Q24X562F |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase [139-480,S378A,S381A,T450D,S473D]
(Homo sapiens (Human)) | BDBM16531
((3Z)-5-(5-{[(2S)-2-amino-3-(1H-indol-3-yl)propyl]o...)Show SMILES N[C@H](COc1cncc(c1)-c1ccc2NC(=O)\C(=C/c3ccco3)c2c1)Cc1c[nH]c2ccccc12 |r| Show InChI InChI=1S/C29H24N4O3/c30-21(10-20-15-32-27-6-2-1-5-24(20)27)17-36-23-11-19(14-31-16-23)18-7-8-28-25(12-18)26(29(34)33-28)13-22-4-3-9-35-22/h1-9,11-16,21,32H,10,17,30H2,(H,33,34)/b26-13-/t21-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.170 | n/a | n/a | n/a | n/a | 7.5 | 22 |
Abbott Laboratories
| Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat... |
J Med Chem 50: 2990-3003 (2007)
Article DOI: 10.1021/jm0701019
BindingDB Entry DOI: 10.7270/Q24X562F |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase [139-480,S378A,S381A,T450D,S473D]
(Homo sapiens (Human)) | BDBM16532
((2S)-1-(1H-indol-3-yl)-3-{[5-(3-methyl-1H-pyrazolo...)Show SMILES Cc1n[nH]c2cnc(cc12)-c1cncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c1 |r| Show InChI InChI=1S/C23H22N6O/c1-14-20-8-22(27-12-23(20)29-28-14)16-7-18(11-25-9-16)30-13-17(24)6-15-10-26-21-5-3-2-4-19(15)21/h2-5,7-12,17,26H,6,13,24H2,1H3,(H,28,29)/t17-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.340 | n/a | n/a | n/a | n/a | 7.5 | 22 |
Abbott Laboratories
| Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat... |
J Med Chem 50: 2990-3003 (2007)
Article DOI: 10.1021/jm0701019
BindingDB Entry DOI: 10.7270/Q24X562F |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase [139-480,S378A,S381A,T450D,S473D]
(Homo sapiens (Human)) | BDBM16587
((2S)-1-{[5-(3-methyl-1H-pyrazolo[3,4-c]pyridin-5-y...)Show SMILES Cc1n[nH]c2cnc(cc12)-c1cncc(OC[C@@H](N)Cc2cccc(c2)C(F)(F)F)c1 |r| Show InChI InChI=1S/C22H20F3N5O/c1-13-19-8-20(28-11-21(19)30-29-13)15-7-18(10-27-9-15)31-12-17(26)6-14-3-2-4-16(5-14)22(23,24)25/h2-5,7-11,17H,6,12,26H2,1H3,(H,29,30)/t17-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.600 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
| Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat... |
J Med Chem 50: 2990-3003 (2007)
Article DOI: 10.1021/jm0701019
BindingDB Entry DOI: 10.7270/Q24X562F |
More data for this
Ligand-Target Pair | |
Glutamate carboxypeptidase 2
(Homo sapiens (Human)) | BDBM50222546
(CHEMBL241779 | tetralithium (2S)-2-(phosphonatoami...)Show SMILES [O-]C(=O)CC[C@H](NP([O-])([O-])=O)C([O-])=O Show InChI InChI=1S/C5H10NO7P/c7-4(8)2-1-3(5(9)10)6-14(11,12)13/h3H,1-2H2,(H,7,8)(H,9,10)(H3,6,11,12,13)/p-4/t3-/m0/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.860 | n/a | n/a | n/a | n/a | n/a | n/a |
San Francisco State University
Curated by ChEMBL
| Assay Description
Inhibition of PSMA |
Bioorg Med Chem 15: 7434-43 (2007)
Article DOI: 10.1016/j.bmc.2007.07.028
BindingDB Entry DOI: 10.7270/Q2057FMF |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase [139-480,S378A,S381A,T450D,S473D]
(Homo sapiens (Human)) | BDBM16548
((2S)-1-(3-iodophenyl)-3-{[5-(3-methyl-1H-indazol-5...)Show SMILES Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2cccc(I)c2)c1 |r| Show InChI InChI=1S/C22H21IN4O/c1-14-21-10-16(5-6-22(21)27-26-14)17-9-20(12-25-11-17)28-13-19(24)8-15-3-2-4-18(23)7-15/h2-7,9-12,19H,8,13,24H2,1H3,(H,26,27)/t19-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.900 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
| Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat... |
J Med Chem 50: 2990-3003 (2007)
Article DOI: 10.1021/jm0701019
BindingDB Entry DOI: 10.7270/Q24X562F |
More data for this
Ligand-Target Pair | |
Receptor-type tyrosine-protein kinase FLT3
(Homo sapiens (Human)) | BDBM50400601
(CHEMBL2203434)Show SMILES CCN1CCC(CC1)Oc1ccc(nc1)C(=O)Nc1ccc(NC(=O)Nc2cc(on2)C(C)(C)C)cc1 Show InChI InChI=1S/C27H34N6O4/c1-5-33-14-12-20(13-15-33)36-21-10-11-22(28-17-21)25(34)29-18-6-8-19(9-7-18)30-26(35)31-24-16-23(37-32-24)27(2,3)4/h6-11,16-17,20H,5,12-15H2,1-4H3,(H,29,34)(H2,30,31,32,35) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of FLT3 phosphorylation in human MV4-11 cells |
ACS Med Chem Lett 3: 997-1002 (2012)
Article DOI: 10.1021/ml300214g
BindingDB Entry DOI: 10.7270/Q22V2H9V |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase [139-480,S378A,S381A,T450D,S473D]
(Homo sapiens (Human)) | BDBM16569
((2S)-1-[6-fluoro-3-(trifluoromethyl)phenyl]-3-{[5-...)Show SMILES Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2cc(ccc2F)C(F)(F)F)c1 |r| Show InChI InChI=1S/C23H20F4N4O/c1-13-20-9-14(2-5-22(20)31-30-13)16-8-19(11-29-10-16)32-12-18(28)7-15-6-17(23(25,26)27)3-4-21(15)24/h2-6,8-11,18H,7,12,28H2,1H3,(H,30,31)/t18-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
| Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat... |
J Med Chem 50: 2990-3003 (2007)
Article DOI: 10.1021/jm0701019
BindingDB Entry DOI: 10.7270/Q24X562F |
More data for this
Ligand-Target Pair | |
Mast/stem cell growth factor receptor Kit
(Homo sapiens (Human)) | BDBM50400602
(CHEMBL2206278)Show SMILES CCN1C(C)(C)CC(CC1(C)C)Oc1ccc(nc1)C(=O)Nc1ccc(NC(=O)Nc2cc(on2)C(C)(C)C)cc1 Show InChI InChI=1S/C31H42N6O4/c1-9-37-30(5,6)17-23(18-31(37,7)8)40-22-14-15-24(32-19-22)27(38)33-20-10-12-21(13-11-20)34-28(39)35-26-16-25(41-36-26)29(2,3)4/h10-16,19,23H,9,17-18H2,1-8H3,(H,33,38)(H2,34,35,36,39) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.20 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of KIT phosphorylation in human H526 cells |
ACS Med Chem Lett 3: 997-1002 (2012)
Article DOI: 10.1021/ml300214g
BindingDB Entry DOI: 10.7270/Q22V2H9V |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase [139-480,S378A,S381A,T450D,S473D]
(Homo sapiens (Human)) | BDBM16564
((2S)-1-{[5-(3-methyl-1H-indazol-5-yl)pyridin-3-yl]...)Show SMILES Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2cccc(c2)C(F)(F)F)c1 |r| Show InChI InChI=1S/C23H21F3N4O/c1-14-21-10-16(5-6-22(21)30-29-14)17-9-20(12-28-11-17)31-13-19(27)8-15-3-2-4-18(7-15)23(24,25)26/h2-7,9-12,19H,8,13,27H2,1H3,(H,29,30)/t19-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
| Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat... |
J Med Chem 50: 2990-3003 (2007)
Article DOI: 10.1021/jm0701019
BindingDB Entry DOI: 10.7270/Q24X562F |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase [139-480,S378A,S381A,T450D,S473D]
(Homo sapiens (Human)) | BDBM16555
((2S)-1-(4-bromo-3-fluorophenyl)-3-{[5-(3-methyl-1H...)Show SMILES Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2ccc(Br)c(F)c2)c1 |r| Show InChI InChI=1S/C22H20BrFN4O/c1-13-19-9-15(3-5-22(19)28-27-13)16-8-18(11-26-10-16)29-12-17(25)6-14-2-4-20(23)21(24)7-14/h2-5,7-11,17H,6,12,25H2,1H3,(H,27,28)/t17-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
| Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat... |
J Med Chem 50: 2990-3003 (2007)
Article DOI: 10.1021/jm0701019
BindingDB Entry DOI: 10.7270/Q24X562F |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50185040
(CHEMBL204828 | N-[1-(1,3-benzodioxol-5-ylmethyl)pi...)Show SMILES Clc1cc2oc(cc(=O)c2cc1Cl)C(=O)NC1CCN(Cc2ccc3OCOc3c2)CC1 Show InChI InChI=1S/C23H20Cl2N2O5/c24-16-8-15-18(28)10-22(32-20(15)9-17(16)25)23(29)26-14-3-5-27(6-4-14)11-13-1-2-19-21(7-13)31-12-30-19/h1-2,7-10,14H,3-6,11-12H2,(H,26,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [3H]dofetilide from hERG |
J Med Chem 49: 6569-84 (2006)
Article DOI: 10.1021/jm060683e
BindingDB Entry DOI: 10.7270/Q2NG4Q7P |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase [139-480,S378A,S381A,T450D,S473D]
(Homo sapiens (Human)) | BDBM16535
((3E)-5-{5-[(2S)-2-amino-3-phenylpropoxy]pyridin-3-...)Show SMILES N[C@H](COc1cncc(c1)-c1ccc2NC(=O)\C(=C\c3ccco3)c2c1)Cc1ccccc1 |r| Show InChI InChI=1S/C27H23N3O3/c28-21(11-18-5-2-1-3-6-18)17-33-23-12-20(15-29-16-23)19-8-9-26-24(13-19)25(27(31)30-26)14-22-7-4-10-32-22/h1-10,12-16,21H,11,17,28H2,(H,30,31)/b25-14+/t21-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.40 | n/a | n/a | n/a | n/a | 7.5 | 22 |
Abbott Laboratories
| Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat... |
J Med Chem 50: 2990-3003 (2007)
Article DOI: 10.1021/jm0701019
BindingDB Entry DOI: 10.7270/Q24X562F |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50162116
(2-(4-(benzyloxy)phenyl)-N-(1-(2-(pyrrolidin-1-yl)e...)Show SMILES O=C(Cc1ccc(OCc2ccccc2)cc1)Nc1ccc2cnn(CCN3CCCC3)c2c1 Show InChI InChI=1S/C28H30N4O2/c33-28(18-22-8-12-26(13-9-22)34-21-23-6-2-1-3-7-23)30-25-11-10-24-20-29-32(27(24)19-25)17-16-31-14-4-5-15-31/h1-3,6-13,19-20H,4-5,14-18,21H2,(H,30,33) | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from MCHr1 expressed in IMR32 (I3.4.2) cells |
J Med Chem 49: 2339-52 (2006)
Article DOI: 10.1021/jm0512286
BindingDB Entry DOI: 10.7270/Q24F1Q9F |
More data for this
Ligand-Target Pair | |
Alpha-1,6-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM272063
(US10065945, Example 57)Show SMILES C[C@@H](N1CCc2ccc(cc2C1)S(=O)(=O)Nc1nc(no1)C(=O)N1CCCC1)c1cc(F)cc(F)c1 |r| Show InChI InChI=1S/C24H25F2N5O4S/c1-15(17-10-19(25)13-20(26)11-17)31-9-6-16-4-5-21(12-18(16)14-31)36(33,34)29-24-27-22(28-35-24)23(32)30-7-2-3-8-30/h4-5,10-13,15H,2-3,6-9,14H2,1H3,(H,27,28,29)/t15-/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 1.60 | n/a | n/a | n/a | n/a | n/a | 25 |
Merck Sharp & Dohme Corp.
US Patent
| Assay Description
A solution of 1 M LiHMDS in THF (51.7 ml, 51.7 mmol) was added dropwise to a mixture of Intermediate 3 (7.5 g, 17.2 mmol) and 5-(tert-butyl)-4-methyl... |
US Patent US10065945 (2018)
BindingDB Entry DOI: 10.7270/Q24X59TJ |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase [139-480,S378A,S381A,T450D,S473D]
(Homo sapiens (Human)) | BDBM16567
((2S)-1-[4-fluoro-3-(trifluoromethyl)phenyl]-3-{[5-...)Show SMILES Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2ccc(F)c(c2)C(F)(F)F)c1 |r| Show InChI InChI=1S/C23H20F4N4O/c1-13-19-9-15(3-5-22(19)31-30-13)16-8-18(11-29-10-16)32-12-17(28)6-14-2-4-21(24)20(7-14)23(25,26)27/h2-5,7-11,17H,6,12,28H2,1H3,(H,30,31)/t17-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.80 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
| Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat... |
J Med Chem 50: 2990-3003 (2007)
Article DOI: 10.1021/jm0701019
BindingDB Entry DOI: 10.7270/Q24X562F |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase [139-480,S378A,S381A,T450D,S473D]
(Homo sapiens (Human)) | BDBM16552
((2S)-1-(3,4-dichlorophenyl)-3-{[5-(3-methyl-1H-ind...)Show SMILES Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2ccc(Cl)c(Cl)c2)c1 |r| Show InChI InChI=1S/C22H20Cl2N4O/c1-13-19-9-15(3-5-22(19)28-27-13)16-8-18(11-26-10-16)29-12-17(25)6-14-2-4-20(23)21(24)7-14/h2-5,7-11,17H,6,12,25H2,1H3,(H,27,28)/t17-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.80 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
| Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat... |
J Med Chem 50: 2990-3003 (2007)
Article DOI: 10.1021/jm0701019
BindingDB Entry DOI: 10.7270/Q24X562F |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50197143
(CHEMBL277531 | N-[1-(1,3-benzodioxol-5-ylmethyl)pi...)Show SMILES Cc1c(oc2cc(Cl)ccc2c1=O)C(=O)NC1CCN(Cc2ccc3OCOc3c2)CC1 Show InChI InChI=1S/C24H23ClN2O5/c1-14-22(28)18-4-3-16(25)11-20(18)32-23(14)24(29)26-17-6-8-27(9-7-17)12-15-2-5-19-21(10-15)31-13-30-19/h2-5,10-11,17H,6-9,12-13H2,1H3,(H,26,29) | Reactome pathway
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UniChem
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PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]MCH from MCHr1 expressed in IMR32 cells |
J Med Chem 49: 6569-84 (2006)
Article DOI: 10.1021/jm060683e
BindingDB Entry DOI: 10.7270/Q2NG4Q7P |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50171590
(CHEMBL194697 | N-(1-Benzo[1,3]dioxol-5-ylmethyl-pi...)Show SMILES Clc1ccc(NCc2nccs2)c(c1)C(=O)NC1CCN(Cc2ccc3OCOc3c2)CC1 Show InChI InChI=1S/C24H25ClN4O3S/c25-17-2-3-20(27-13-23-26-7-10-33-23)19(12-17)24(30)28-18-5-8-29(9-6-18)14-16-1-4-21-22(11-16)32-15-31-21/h1-4,7,10-12,18,27H,5-6,8-9,13-15H2,(H,28,30) | Reactome pathway
KEGG
UniProtKB/SwissProt
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| CHEMBL
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UniChem
| Article
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| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from MCHr1 expressed in IMR32 (I3.4.2) cells |
J Med Chem 49: 2339-52 (2006)
Article DOI: 10.1021/jm0512286
BindingDB Entry DOI: 10.7270/Q24F1Q9F |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50173460
(4-(1-(benzo[d][1,3]dioxol-5-ylmethyl)piperidin-4-y...)Show SMILES COc1ccc2oc(=O)cc(NC3CCN(Cc4ccc5OCOc5c4)CC3)c2c1 Show InChI InChI=1S/C23H24N2O5/c1-27-17-3-5-20-18(11-17)19(12-23(26)30-20)24-16-6-8-25(9-7-16)13-15-2-4-21-22(10-15)29-14-28-21/h2-5,10-12,16,24H,6-9,13-14H2,1H3 | Reactome pathway
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| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from MCHr1 expressed in IMR32 (I3.4.2) cells |
J Med Chem 49: 2339-52 (2006)
Article DOI: 10.1021/jm0512286
BindingDB Entry DOI: 10.7270/Q24F1Q9F |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase [139-480,S378A,S381A,T450D,S473D]
(Homo sapiens (Human)) | BDBM15067
((2S)-1-(1H-indol-3-yl)-3-(5-isoquinolin-6-ylpyridi...)Show SMILES N[C@H](COc1cncc(c1)-c1ccc2cnccc2c1)Cc1c[nH]c2ccccc12 |r| Show InChI InChI=1S/C25H22N4O/c26-22(10-21-14-29-25-4-2-1-3-24(21)25)16-30-23-11-20(13-28-15-23)17-5-6-19-12-27-8-7-18(19)9-17/h1-9,11-15,22,29H,10,16,26H2/t22-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| MMDB
PC cid
PC sid
PDB
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | 7.5 | 22 |
Abbott Laboratories
| Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat... |
J Med Chem 50: 2990-3003 (2007)
Article DOI: 10.1021/jm0701019
BindingDB Entry DOI: 10.7270/Q24X562F |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50197136
(CHEMBL387178 | N-[1-(1,3-benzodioxol-5-ylmethyl)pi...)Show SMILES Fc1cc2oc(cc(=O)c2cc1F)C(=O)NC1CCN(Cc2ccc3OCOc3c2)CC1 Show InChI InChI=1S/C23H20F2N2O5/c24-16-8-15-18(28)10-22(32-20(15)9-17(16)25)23(29)26-14-3-5-27(6-4-14)11-13-1-2-19-21(7-13)31-12-30-19/h1-2,7-10,14H,3-6,11-12H2,(H,26,29) | Reactome pathway
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| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]MCH from MCHr1 expressed in IMR32 cells |
J Med Chem 49: 6569-84 (2006)
Article DOI: 10.1021/jm060683e
BindingDB Entry DOI: 10.7270/Q2NG4Q7P |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50197135
(CHEMBL217442 | N-[1-(1,3-benzodioxol-5-ylmethyl)pi...)Show SMILES COc1cc2oc(cc(=O)c2cc1F)C(=O)NC1CCN(Cc2ccc3OCOc3c2)CC1 Show InChI InChI=1S/C24H23FN2O6/c1-30-21-11-20-16(9-17(21)25)18(28)10-23(33-20)24(29)26-15-4-6-27(7-5-15)12-14-2-3-19-22(8-14)32-13-31-19/h2-3,8-11,15H,4-7,12-13H2,1H3,(H,26,29) | Reactome pathway
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| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]MCH from MCHr1 expressed in IMR32 cells |
J Med Chem 49: 6569-84 (2006)
Article DOI: 10.1021/jm060683e
BindingDB Entry DOI: 10.7270/Q2NG4Q7P |
More data for this
Ligand-Target Pair | |
Receptor-type tyrosine-protein kinase FLT3
(Homo sapiens (Human)) | BDBM50400602
(CHEMBL2206278)Show SMILES CCN1C(C)(C)CC(CC1(C)C)Oc1ccc(nc1)C(=O)Nc1ccc(NC(=O)Nc2cc(on2)C(C)(C)C)cc1 Show InChI InChI=1S/C31H42N6O4/c1-9-37-30(5,6)17-23(18-31(37,7)8)40-22-14-15-24(32-19-22)27(38)33-20-10-12-21(13-11-20)34-28(39)35-26-16-25(41-36-26)29(2,3)4/h10-16,19,23H,9,17-18H2,1-8H3,(H,33,38)(H2,34,35,36,39) | PDB
NCI pathway
Reactome pathway
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MCE
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| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of FLT3 phosphorylation in human MV4-11 cells |
ACS Med Chem Lett 3: 997-1002 (2012)
Article DOI: 10.1021/ml300214g
BindingDB Entry DOI: 10.7270/Q22V2H9V |
More data for this
Ligand-Target Pair | |
Receptor-type tyrosine-protein kinase FLT3
(Homo sapiens (Human)) | BDBM50400600
(CHEMBL2206277)Show SMILES CN1C(C)(C)CC(CC1(C)C)Oc1ccc(nc1)C(=O)Nc1ccc(NC(=O)Nc2cc(on2)C(C)(C)C)cc1 Show InChI InChI=1S/C30H40N6O4/c1-28(2,3)24-15-25(35-40-24)34-27(38)33-20-11-9-19(10-12-20)32-26(37)23-14-13-21(18-31-23)39-22-16-29(4,5)36(8)30(6,7)17-22/h9-15,18,22H,16-17H2,1-8H3,(H,32,37)(H2,33,34,35,38) | PDB
NCI pathway
Reactome pathway
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UniChem
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| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of FLT3 phosphorylation in human MV4-11 cells |
ACS Med Chem Lett 3: 997-1002 (2012)
Article DOI: 10.1021/ml300214g
BindingDB Entry DOI: 10.7270/Q22V2H9V |
More data for this
Ligand-Target Pair | |
Macrophage colony-stimulating factor 1 receptor
(Homo sapiens (Human)) | BDBM50255518
(4-(3,4-dichlorophenylamino)-7-methoxy-6-(4-methylp...)Show SMILES COc1cc2ncc(C(N)=O)c(Nc3ccc(Cl)c(Cl)c3)c2cc1N1CCN(C)CC1 Show InChI InChI=1S/C22H23Cl2N5O2/c1-28-5-7-29(8-6-28)19-10-14-18(11-20(19)31-2)26-12-15(22(25)30)21(14)27-13-3-4-16(23)17(24)9-13/h3-4,9-12H,5-8H2,1-2H3,(H2,25,30)(H,26,27) | PDB
UniProtKB/SwissProt
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| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca R&D Boston
Curated by ChEMBL
| Assay Description
Inhibition of CSF1R (unknown origin) |
Bioorg Med Chem Lett 19: 701-5 (2009)
Article DOI: 10.1016/j.bmcl.2008.12.044
BindingDB Entry DOI: 10.7270/Q2JW8DSV |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase [139-480,S378A,S381A,T450D,S473D]
(Homo sapiens (Human)) | BDBM16546
((2S)-1-(3-bromophenyl)-3-{[5-(3-methyl-1H-indazol-...)Show SMILES Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2cccc(Br)c2)c1 |r| Show InChI InChI=1S/C22H21BrN4O/c1-14-21-10-16(5-6-22(21)27-26-14)17-9-20(12-25-11-17)28-13-19(24)8-15-3-2-4-18(23)7-15/h2-7,9-12,19H,8,13,24H2,1H3,(H,26,27)/t19-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
| Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat... |
J Med Chem 50: 2990-3003 (2007)
Article DOI: 10.1021/jm0701019
BindingDB Entry DOI: 10.7270/Q24X562F |
More data for this
Ligand-Target Pair | |
Glutamate carboxypeptidase 2
(Homo sapiens (Human)) | BDBM50222549
((S)-2-phosphonoamino-pentanedioic acid | CHEMBL238...)Show InChI InChI=1S/C5H10NO7P/c7-4(8)2-1-3(5(9)10)6-14(11,12)13/h3H,1-2H2,(H,7,8)(H,9,10)(H3,6,11,12,13)/t3-/m0/s1 | PDB
MMDB
KEGG
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| CHEMBL
KEGG
PC cid
PC sid
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| Article
PubMed
| n/a | n/a | 2.30 | n/a | n/a | n/a | n/a | n/a | n/a |
San Francisco State University
Curated by ChEMBL
| Assay Description
Inhibition of PSMA |
Bioorg Med Chem 15: 7434-43 (2007)
Article DOI: 10.1016/j.bmc.2007.07.028
BindingDB Entry DOI: 10.7270/Q2057FMF |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase [139-480,S378A,S381A,T450D,S473D]
(Homo sapiens (Human)) | BDBM16561
((2S)-1-(3-fluoro-4-methylphenyl)-3-{[5-(3-methyl-1...)Show SMILES Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2ccc(C)c(F)c2)c1 |r| Show InChI InChI=1S/C23H23FN4O/c1-14-3-4-16(8-22(14)24)7-19(25)13-29-20-9-18(11-26-12-20)17-5-6-23-21(10-17)15(2)27-28-23/h3-6,8-12,19H,7,13,25H2,1-2H3,(H,27,28)/t19-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
| Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat... |
J Med Chem 50: 2990-3003 (2007)
Article DOI: 10.1021/jm0701019
BindingDB Entry DOI: 10.7270/Q24X562F |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase [139-480,S378A,S381A,T450D,S473D]
(Homo sapiens (Human)) | BDBM16558
((2S)-1-(3-methyl-4-bromophenyl)-3-{[5-(3-methyl-1H...)Show SMILES Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2ccc(Br)c(C)c2)c1 |r| Show InChI InChI=1S/C23H23BrN4O/c1-14-7-16(3-5-22(14)24)8-19(25)13-29-20-9-18(11-26-12-20)17-4-6-23-21(10-17)15(2)27-28-23/h3-7,9-12,19H,8,13,25H2,1-2H3,(H,27,28)/t19-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
| Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat... |
J Med Chem 50: 2990-3003 (2007)
Article DOI: 10.1021/jm0701019
BindingDB Entry DOI: 10.7270/Q24X562F |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50197116
(CHEMBL217706 | N-[1-(1,3-benzodioxol-5-ylmethyl)pi...)Show SMILES Brc1ccc2c(c1)oc(cc2=O)C(=O)NC1CCN(Cc2ccc3OCOc3c2)CC1 Show InChI InChI=1S/C23H21BrN2O5/c24-15-2-3-17-18(27)11-22(31-20(17)10-15)23(28)25-16-5-7-26(8-6-16)12-14-1-4-19-21(9-14)30-13-29-19/h1-4,9-11,16H,5-8,12-13H2,(H,25,28) | PDB
MMDB
Reactome pathway
KEGG
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B.MOAD
DrugBank
antibodypedia
GoogleScholar
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [3H]dofetilide from hERG |
J Med Chem 49: 6569-84 (2006)
Article DOI: 10.1021/jm060683e
BindingDB Entry DOI: 10.7270/Q2NG4Q7P |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase [139-480,S378A,S381A,T450D,S473D]
(Homo sapiens (Human)) | BDBM16586
((2S)-1-{[5-(3-chloro-1H-pyrazolo[3,4-c]pyridin-5-y...)Show SMILES N[C@H](COc1cncc(c1)-c1cc2c(Cl)n[nH]c2cn1)Cc1cccc(c1)C(F)(F)F |r| Show InChI InChI=1S/C21H17ClF3N5O/c22-20-17-7-18(28-10-19(17)29-30-20)13-6-16(9-27-8-13)31-11-15(26)5-12-2-1-3-14(4-12)21(23,24)25/h1-4,6-10,15H,5,11,26H2,(H,29,30)/t15-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
| Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat... |
J Med Chem 50: 2990-3003 (2007)
Article DOI: 10.1021/jm0701019
BindingDB Entry DOI: 10.7270/Q24X562F |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50185040
(CHEMBL204828 | N-[1-(1,3-benzodioxol-5-ylmethyl)pi...)Show SMILES Clc1cc2oc(cc(=O)c2cc1Cl)C(=O)NC1CCN(Cc2ccc3OCOc3c2)CC1 Show InChI InChI=1S/C23H20Cl2N2O5/c24-16-8-15-18(28)10-22(32-20(15)9-17(16)25)23(29)26-14-3-5-27(6-4-14)11-13-1-2-19-21(7-13)31-12-30-19/h1-2,7-10,14H,3-6,11-12H2,(H,26,29) | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from MCHr1 expressed in IMR32 (I3.4.2) cells |
J Med Chem 49: 2339-52 (2006)
Article DOI: 10.1021/jm0512286
BindingDB Entry DOI: 10.7270/Q24F1Q9F |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50185040
(CHEMBL204828 | N-[1-(1,3-benzodioxol-5-ylmethyl)pi...)Show SMILES Clc1cc2oc(cc(=O)c2cc1Cl)C(=O)NC1CCN(Cc2ccc3OCOc3c2)CC1 Show InChI InChI=1S/C23H20Cl2N2O5/c24-16-8-15-18(28)10-22(32-20(15)9-17(16)25)23(29)26-14-3-5-27(6-4-14)11-13-1-2-19-21(7-13)31-12-30-19/h1-2,7-10,14H,3-6,11-12H2,(H,26,29) | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]MCH from MCHr1 expressed in IMR32 cells |
J Med Chem 49: 6569-84 (2006)
Article DOI: 10.1021/jm060683e
BindingDB Entry DOI: 10.7270/Q2NG4Q7P |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50197144
(CHEMBL387418 | N-[1-(1,3-benzodioxol-5-ylmethyl)pi...)Show SMILES Fc1cc2c(cc1Cl)oc(cc2=O)C(=O)NC1CCN(Cc2ccc3OCOc3c2)CC1 Show InChI InChI=1S/C23H20ClFN2O5/c24-16-9-20-15(8-17(16)25)18(28)10-22(32-20)23(29)26-14-3-5-27(6-4-14)11-13-1-2-19-21(7-13)31-12-30-19/h1-2,7-10,14H,3-6,11-12H2,(H,26,29) | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]MCH from MCHr1 expressed in IMR32 cells |
J Med Chem 49: 6569-84 (2006)
Article DOI: 10.1021/jm060683e
BindingDB Entry DOI: 10.7270/Q2NG4Q7P |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50197139
(CHEMBL214021 | N-(1-(benzo[d][1,3]dioxol-5-ylmethy...)Show SMILES Fc1ccc2c(c1)oc(cc2=O)C(=O)NC1CCN(Cc2ccc3OCOc3c2)CC1 Show InChI InChI=1S/C23H21FN2O5/c24-15-2-3-17-18(27)11-22(31-20(17)10-15)23(28)25-16-5-7-26(8-6-16)12-14-1-4-19-21(9-14)30-13-29-19/h1-4,9-11,16H,5-8,12-13H2,(H,25,28) | Reactome pathway
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| Article
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| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]MCH from MCHr1 expressed in IMR32 cells |
J Med Chem 49: 6569-84 (2006)
Article DOI: 10.1021/jm060683e
BindingDB Entry DOI: 10.7270/Q2NG4Q7P |
More data for this
Ligand-Target Pair | |
Macrophage colony-stimulating factor 1 receptor
(Homo sapiens (Human)) | BDBM50255517
(4-(2,4-dichlorophenylamino)-7-methoxy-6-(4-methylp...)Show SMILES COc1cc2ncc(C(N)=O)c(Nc3ccc(Cl)cc3Cl)c2cc1N1CCN(C)CC1 Show InChI InChI=1S/C22H23Cl2N5O2/c1-28-5-7-29(8-6-28)19-10-14-18(11-20(19)31-2)26-12-15(22(25)30)21(14)27-17-4-3-13(23)9-16(17)24/h3-4,9-12H,5-8H2,1-2H3,(H2,25,30)(H,26,27) | PDB
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| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca R&D Boston
Curated by ChEMBL
| Assay Description
Inhibition of CSF1R (unknown origin) |
Bioorg Med Chem Lett 19: 701-5 (2009)
Article DOI: 10.1016/j.bmcl.2008.12.044
BindingDB Entry DOI: 10.7270/Q2JW8DSV |
More data for this
Ligand-Target Pair | |
Macrophage colony-stimulating factor 1 receptor
(Homo sapiens (Human)) | BDBM50255594
(4-(2,3-dichlorophenylamino)-7-fluoro-6-(4-methylpi...)Show SMILES CN1CCN(CC1)c1cc2c(Nc3cccc(Cl)c3Cl)c(cnc2cc1F)C(N)=O Show InChI InChI=1S/C21H20Cl2FN5O/c1-28-5-7-29(8-6-28)18-9-12-17(10-15(18)24)26-11-13(21(25)30)20(12)27-16-4-2-3-14(22)19(16)23/h2-4,9-11H,5-8H2,1H3,(H2,25,30)(H,26,27) | PDB
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| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca R&D Boston
Curated by ChEMBL
| Assay Description
Inhibition of CSF1R (unknown origin) |
Bioorg Med Chem Lett 19: 701-5 (2009)
Article DOI: 10.1016/j.bmcl.2008.12.044
BindingDB Entry DOI: 10.7270/Q2JW8DSV |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase [139-480,S378A,S381A,T450D,S473D]
(Homo sapiens (Human)) | BDBM16570
((2S)-1-[3-fluoro-4-(trifluoromethyl)phenyl]-3-{[5-...)Show SMILES Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2ccc(c(F)c2)C(F)(F)F)c1 |r| Show InChI InChI=1S/C23H20F4N4O/c1-13-19-9-15(3-5-22(19)31-30-13)16-8-18(11-29-10-16)32-12-17(28)6-14-2-4-20(21(24)7-14)23(25,26)27/h2-5,7-11,17H,6,12,28H2,1H3,(H,30,31)/t17-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
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| PC cid
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UniChem
Similars
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PubMed
| n/a | n/a | 3.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
| Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat... |
J Med Chem 50: 2990-3003 (2007)
Article DOI: 10.1021/jm0701019
BindingDB Entry DOI: 10.7270/Q24X562F |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase [139-480,S378A,S381A,T450D,S473D]
(Homo sapiens (Human)) | BDBM16549
((2S)-1-(3-chloro-4-fluorophenyl)-3-{[5-(3-methyl-1...)Show SMILES Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2ccc(F)c(Cl)c2)c1 |r| Show InChI InChI=1S/C22H20ClFN4O/c1-13-19-9-15(3-5-22(19)28-27-13)16-8-18(11-26-10-16)29-12-17(25)6-14-2-4-21(24)20(23)7-14/h2-5,7-11,17H,6,12,25H2,1H3,(H,27,28)/t17-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
| Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat... |
J Med Chem 50: 2990-3003 (2007)
Article DOI: 10.1021/jm0701019
BindingDB Entry DOI: 10.7270/Q24X562F |
More data for this
Ligand-Target Pair | |
Thromboxane-A synthase
(Homo sapiens (Human)) | BDBM50025953
(6-Imidazo[1,5-a]pyridin-5-yl-hexanoic acid | CGS-1...)Show InChI InChI=1S/C13H16N2O2/c16-13(17)8-3-1-2-5-11-6-4-7-12-9-14-10-15(11)12/h4,6-7,9-10H,1-3,5,8H2,(H,16,17) | KEGG
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| n/a | n/a | 3.20 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro inhibitory activity against thromboxane A2 synthetase with lysed human platelets as the enzyme source. |
J Med Chem 28: 164-70 (1985)
BindingDB Entry DOI: 10.7270/Q22B8ZKX |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase [139-480,S378A,S381A,T450D,S473D]
(Homo sapiens (Human)) | BDBM16573
((2S)-1-{[5-(3-methyl-1H-indazol-5-yl)pyridin-3-yl]...)Show SMILES Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2cccc(OC(F)(F)F)c2)c1 |r| Show InChI InChI=1S/C23H21F3N4O2/c1-14-21-10-16(5-6-22(21)30-29-14)17-9-20(12-28-11-17)31-13-18(27)7-15-3-2-4-19(8-15)32-23(24,25)26/h2-6,8-12,18H,7,13,27H2,1H3,(H,29,30)/t18-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
| Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat... |
J Med Chem 50: 2990-3003 (2007)
Article DOI: 10.1021/jm0701019
BindingDB Entry DOI: 10.7270/Q24X562F |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50197111
(CHEMBL213715 | N-[1-(1,3-benzodioxol-5-ylmethyl)pi...)Show SMILES FC(F)Oc1ccc2c(c1)oc(cc2=O)C(=O)NC1CCN(Cc2ccc3OCOc3c2)CC1 Show InChI InChI=1S/C24H22F2N2O6/c25-24(26)33-16-2-3-17-18(29)11-22(34-20(17)10-16)23(30)27-15-5-7-28(8-6-15)12-14-1-4-19-21(9-14)32-13-31-19/h1-4,9-11,15,24H,5-8,12-13H2,(H,27,30) | PDB
MMDB
Reactome pathway
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| CHEMBL
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UniChem
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PubMed
| n/a | n/a | 3.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [3H]dofetilide from hERG |
J Med Chem 49: 6569-84 (2006)
Article DOI: 10.1021/jm060683e
BindingDB Entry DOI: 10.7270/Q2NG4Q7P |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase [139-480,S378A,S381A,T450D,S473D]
(Homo sapiens (Human)) | BDBM16550
((2S)-1-(3-fluoro-4-chlorophenyl)-3-{[5-(3-methyl-1...)Show SMILES Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2ccc(Cl)c(F)c2)c1 |r| Show InChI InChI=1S/C22H20ClFN4O/c1-13-19-9-15(3-5-22(19)28-27-13)16-8-18(11-26-10-16)29-12-17(25)6-14-2-4-20(23)21(24)7-14/h2-5,7-11,17H,6,12,25H2,1H3,(H,27,28)/t17-/m0/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
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| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
| Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat... |
J Med Chem 50: 2990-3003 (2007)
Article DOI: 10.1021/jm0701019
BindingDB Entry DOI: 10.7270/Q24X562F |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50197124
(CHEMBL217789 | N-[1-(1,3-benzodioxol-5-ylmethyl)pi...)Show SMILES Clc1ccc2c(c1)oc(cc2=O)C(=O)NC1CCN(Cc2ccc3OCOc3c2)CC1 Show InChI InChI=1S/C23H21ClN2O5/c24-15-2-3-17-18(27)11-22(31-20(17)10-15)23(28)25-16-5-7-26(8-6-16)12-14-1-4-19-21(9-14)30-13-29-19/h1-4,9-11,16H,5-8,12-13H2,(H,25,28) | PDB
MMDB
Reactome pathway
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UniChem
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| n/a | n/a | 3.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [3H]dofetilide from hERG |
J Med Chem 49: 6569-84 (2006)
Article DOI: 10.1021/jm060683e
BindingDB Entry DOI: 10.7270/Q2NG4Q7P |
More data for this
Ligand-Target Pair | |
Alpha-1,6-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM272061
(US10065945, Example 55)Show SMILES C[C@@H](N1CCc2ccc(cc2C1)S(=O)(=O)Nc1nc(no1)C(=O)N1CCC1)c1cc(F)cc(F)c1 |r| Show InChI InChI=1S/C23H23F2N5O4S/c1-14(16-9-18(24)12-19(25)10-16)30-8-5-15-3-4-20(11-17(15)13-30)35(32,33)28-23-26-21(27-34-23)22(31)29-6-2-7-29/h3-4,9-12,14H,2,5-8,13H2,1H3,(H,26,27,28)/t14-/m1/s1 | PDB
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| US Patent
| n/a | n/a | 3.70 | n/a | n/a | n/a | n/a | n/a | 25 |
Merck Sharp & Dohme Corp.
US Patent
| Assay Description
A solution of 1 M LiHMDS in THF (51.7 ml, 51.7 mmol) was added dropwise to a mixture of Intermediate 3 (7.5 g, 17.2 mmol) and 5-(tert-butyl)-4-methyl... |
US Patent US10065945 (2018)
BindingDB Entry DOI: 10.7270/Q24X59TJ |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase [139-480,S378A,S381A,T450D,S473D]
(Homo sapiens (Human)) | BDBM16557
((2S)-1-(5-fluoro-2-methylphenyl)-3-{[5-(3-methyl-1...)Show SMILES Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2cc(F)ccc2C)c1 |r| Show InChI InChI=1S/C23H23FN4O/c1-14-3-5-19(24)7-17(14)8-20(25)13-29-21-9-18(11-26-12-21)16-4-6-23-22(10-16)15(2)27-28-23/h3-7,9-12,20H,8,13,25H2,1-2H3,(H,27,28)/t20-/m0/s1 | PDB
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UniProtKB/SwissProt
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| PC cid
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UniChem
Similars
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| n/a | n/a | 3.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
| Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat... |
J Med Chem 50: 2990-3003 (2007)
Article DOI: 10.1021/jm0701019
BindingDB Entry DOI: 10.7270/Q24X562F |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human)) | BDBM50185041
(CHEMBL380429 | N-(4-phenoxyphenyl)-N'-[1-(2-azepan...)Show SMILES O=C(Nc1ccc(Oc2ccccc2)cc1)Nc1ccc2n(CCN3CCCCCC3)ncc2c1 Show InChI InChI=1S/C28H31N5O2/c34-28(30-23-10-13-26(14-11-23)35-25-8-4-3-5-9-25)31-24-12-15-27-22(20-24)21-29-33(27)19-18-32-16-6-1-2-7-17-32/h3-5,8-15,20-21H,1-2,6-7,16-19H2,(H2,30,31,34) | Reactome pathway
KEGG
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PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]-MCH from MCHr1 expressed in IMR32 (I3.4.2) cells |
J Med Chem 49: 2339-52 (2006)
Article DOI: 10.1021/jm0512286
BindingDB Entry DOI: 10.7270/Q24F1Q9F |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50197113
(CHEMBL214731 | N-(1-(benzo[d][1,3]dioxol-5-ylmethy...)Show SMILES Fc1ccc2oc(cc(=O)c2c1)C(=O)NC1CCN(Cc2ccc3OCOc3c2)CC1 Show InChI InChI=1S/C23H21FN2O5/c24-15-2-4-19-17(10-15)18(27)11-22(31-19)23(28)25-16-5-7-26(8-6-16)12-14-1-3-20-21(9-14)30-13-29-20/h1-4,9-11,16H,5-8,12-13H2,(H,25,28) | PDB
MMDB
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| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [3H]dofetilide from hERG |
J Med Chem 49: 6569-84 (2006)
Article DOI: 10.1021/jm060683e
BindingDB Entry DOI: 10.7270/Q2NG4Q7P |
More data for this
Ligand-Target Pair | |
Thromboxane-A synthase
(Homo sapiens (Human)) | BDBM50025970
(6-Imidazo[1,5-a]pyridin-5-yl-hex-2-enoic acid | CH...)Show InChI InChI=1S/C13H14N2O2/c16-13(17)8-3-1-2-5-11-6-4-7-12-9-14-10-15(11)12/h3-4,6-10H,1-2,5H2,(H,16,17)/b8-3+ | KEGG
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Similars
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| n/a | n/a | 4.80 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro inhibition of thromboxane A2 synthetase from human platelets. |
J Med Chem 28: 164-70 (1985)
BindingDB Entry DOI: 10.7270/Q22B8ZKX |
More data for this
Ligand-Target Pair | |
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