BindingDB logo
myBDB logout

26 similar compounds to monomer 50232346

Compile data set for download or QSAR
Wt: 336.5
BDBM50232355
Wt: 367.5
BDBM50242842
Wt: 393.5
BDBM50242843
Wt: 353.5
BDBM50242844
Wt: 414.5
BDBM50243638
Wt: 400.5
BDBM50243073
Wt: 352.5
BDBM50243119
Wt: 378.5
BDBM50243120
Wt: 340.4
BDBM50243121
Wt: 366.5
BDBM50243122
Wt: 392.5
BDBM50243123
Wt: 397.4
BDBM50232365
Wt: 277.2
BDBM50232345
Wt: 337.4
BDBM50232351
Wt: 473.9
BDBM50232366
Displayed 1 to 15 (of 26 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 23 hits for monomerid = 50232355,50242842,50242843,50242844,50243638,50243073,50243119,50243120,50243121,50243122,50243123,50232365,50232345,50232351,50232366   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50232355
PNG
((3aR,6aR)-2-(cyclopropylmethyl)-6-(4-(2-(pyrrolidi...)
Show SMILES C(Cc1ccc(cc1)C1=CC[C@H]2CN(CC3CC3)C[C@@H]12)N1CCCC1
Show InChI InChI=1S/C23H32N2/c1-2-13-24(12-1)14-11-18-5-7-20(8-6-18)22-10-9-21-16-25(17-23(21)22)15-19-3-4-19/h5-8,10,19,21,23H,1-4,9,11-17H2/t21-,23+/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.0700n/an/an/an/an/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement of N-[3H]methylhistamine from histamine H3 receptor in rat cortex membrane


Bioorg Med Chem Lett 18: 4133-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.086
BindingDB Entry DOI: 10.7270/Q2C82942
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50232355
PNG
((3aR,6aR)-2-(cyclopropylmethyl)-6-(4-(2-(pyrrolidi...)
Show SMILES C(Cc1ccc(cc1)C1=CC[C@H]2CN(CC3CC3)C[C@@H]12)N1CCCC1
Show InChI InChI=1S/C23H32N2/c1-2-13-24(12-1)14-11-18-5-7-20(8-6-18)22-10-9-21-16-25(17-23(21)22)15-19-3-4-19/h5-8,10,19,21,23H,1-4,9,11-17H2/t21-,23+/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.0700n/an/an/an/an/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement of N-[3H]methylhistamine from histamine H3 receptor in rat cortex


Bioorg Med Chem Lett 18: 1490-4 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.059
BindingDB Entry DOI: 10.7270/Q2Q81DZS
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50232355
PNG
((3aR,6aR)-2-(cyclopropylmethyl)-6-(4-(2-(pyrrolidi...)
Show SMILES C(Cc1ccc(cc1)C1=CC[C@H]2CN(CC3CC3)C[C@@H]12)N1CCCC1
Show InChI InChI=1S/C23H32N2/c1-2-13-24(12-1)14-11-18-5-7-20(8-6-18)22-10-9-21-16-25(17-23(21)22)15-19-3-4-19/h5-8,10,19,21,23H,1-4,9,11-17H2/t21-,23+/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.100n/an/an/an/an/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement of N-[3H]methylhistamine from histamine H3 receptor in rat cortex


Bioorg Med Chem Lett 18: 1490-4 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.059
BindingDB Entry DOI: 10.7270/Q2Q81DZS
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50243638
PNG
(1-((3aR,6aR)-6-(4-(2-((R)-2-methylpyrrolidin-1-yl)...)
Show SMILES C[C@@H]1CCCN1CCc1ccc(cc1)C1=CC[C@H]2CN(C[C@@H]12)C(=O)Cc1ccccc1
Show InChI InChI=1S/C28H34N2O/c1-21-6-5-16-29(21)17-15-22-9-11-24(12-10-22)26-14-13-25-19-30(20-27(25)26)28(31)18-23-7-3-2-4-8-23/h2-4,7-12,14,21,25,27H,5-6,13,15-20H2,1H3/t21-,25+,27-/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.300n/an/an/an/an/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement of N-[3H]methylhistamine from histamine H3 receptor in rat cortex membrane


Bioorg Med Chem Lett 18: 4133-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.086
BindingDB Entry DOI: 10.7270/Q2C82942
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50243123
PNG
(CHEMBL488464 | cyclopentyl((3aR,6aR)-6-(4-(2-((R)-...)
Show SMILES C[C@@H]1CCCN1CCc1ccc(cc1)C1=CC[C@H]2CN(C[C@@H]12)C(=O)C1CCCC1
Show InChI InChI=1S/C26H36N2O/c1-19-5-4-15-27(19)16-14-20-8-10-21(11-9-20)24-13-12-23-17-28(18-25(23)24)26(29)22-6-2-3-7-22/h8-11,13,19,22-23,25H,2-7,12,14-18H2,1H3/t19-,23+,25-/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.400n/an/an/an/an/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement of N-[3H]methylhistamine from histamine H3 receptor in rat cortex membrane


Bioorg Med Chem Lett 18: 4133-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.086
BindingDB Entry DOI: 10.7270/Q2C82942
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50243122
PNG
(2-methyl-1-((3aR,6aR)-6-(4-(2-((R)-2-methylpyrroli...)
Show SMILES CC(C)C(=O)N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCC[C@H]2C)cc1
Show InChI InChI=1S/C24H34N2O/c1-17(2)24(27)26-15-21-10-11-22(23(21)16-26)20-8-6-19(7-9-20)12-14-25-13-4-5-18(25)3/h6-9,11,17-18,21,23H,4-5,10,12-16H2,1-3H3/t18-,21+,23-/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.400n/an/an/an/an/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement of N-[3H]methylhistamine from histamine H3 receptor in rat cortex membrane


Bioorg Med Chem Lett 18: 4133-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.086
BindingDB Entry DOI: 10.7270/Q2C82942
More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM50232355
PNG
((3aR,6aR)-2-(cyclopropylmethyl)-6-(4-(2-(pyrrolidi...)
Show SMILES C(Cc1ccc(cc1)C1=CC[C@H]2CN(CC3CC3)C[C@@H]12)N1CCCC1
Show InChI InChI=1S/C23H32N2/c1-2-13-24(12-1)14-11-18-5-7-20(8-6-18)22-10-9-21-16-25(17-23(21)22)15-19-3-4-19/h5-8,10,19,21,23H,1-4,9,11-17H2/t21-,23+/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.900n/an/an/an/an/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H3 receptor expressed in CHOK1 cells by [3H]R(-)-alpha-methylhistamine displacement assay


Bioorg Med Chem Lett 18: 4133-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.086
BindingDB Entry DOI: 10.7270/Q2C82942
More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM50232355
PNG
((3aR,6aR)-2-(cyclopropylmethyl)-6-(4-(2-(pyrrolidi...)
Show SMILES C(Cc1ccc(cc1)C1=CC[C@H]2CN(CC3CC3)C[C@@H]12)N1CCCC1
Show InChI InChI=1S/C23H32N2/c1-2-13-24(12-1)14-11-18-5-7-20(8-6-18)22-10-9-21-16-25(17-23(21)22)15-19-3-4-19/h5-8,10,19,21,23H,1-4,9,11-17H2/t21-,23+/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1n/an/an/an/an/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Inverse agonist activity at human H3 receptor expressed in CHOK1 cells by GTPgammaS binding assay


Bioorg Med Chem Lett 18: 4133-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.086
BindingDB Entry DOI: 10.7270/Q2C82942
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50243120
PNG
(CHEMBL520719 | cyclopentyl((3aR,6aR)-6-(4-(2-(pyrr...)
Show SMILES O=C(C1CCCC1)N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCCC2)cc1
Show InChI InChI=1S/C25H34N2O/c28-25(21-5-1-2-6-21)27-17-22-11-12-23(24(22)18-27)20-9-7-19(8-10-20)13-16-26-14-3-4-15-26/h7-10,12,21-22,24H,1-6,11,13-18H2/t22-,24+/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
3n/an/an/an/an/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement of N-[3H]methylhistamine from histamine H3 receptor in rat cortex membrane


Bioorg Med Chem Lett 18: 4133-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.086
BindingDB Entry DOI: 10.7270/Q2C82942
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50243119
PNG
(2-methyl-1-((3aR,6aR)-6-(4-(2-(pyrrolidin-1-yl)eth...)
Show SMILES CC(C)C(=O)N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCCC2)cc1
Show InChI InChI=1S/C23H32N2O/c1-17(2)23(26)25-15-20-9-10-21(22(20)16-25)19-7-5-18(6-8-19)11-14-24-12-3-4-13-24/h5-8,10,17,20,22H,3-4,9,11-16H2,1-2H3/t20-,22+/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
5n/an/an/an/an/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement of N-[3H]methylhistamine from histamine H3 receptor in rat cortex membrane


Bioorg Med Chem Lett 18: 4133-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.086
BindingDB Entry DOI: 10.7270/Q2C82942
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50243121
PNG
(2-hydroxy-1-((3aR,6aR)-6-(4-(2-(pyrrolidin-1-yl)et...)
Show SMILES OCC(=O)N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCCC2)cc1
Show InChI InChI=1S/C21H28N2O2/c24-15-21(25)23-13-18-7-8-19(20(18)14-23)17-5-3-16(4-6-17)9-12-22-10-1-2-11-22/h3-6,8,18,20,24H,1-2,7,9-15H2/t18-,20+/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
6n/an/an/an/an/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement of N-[3H]methylhistamine from histamine H3 receptor in rat cortex membrane


Bioorg Med Chem Lett 18: 4133-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.086
BindingDB Entry DOI: 10.7270/Q2C82942
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50243073
PNG
(2-phenyl-1-((3aR,6aR)-6-(4-(2-(pyrrolidin-1-yl)eth...)
Show SMILES O=C(Cc1ccccc1)N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCCC2)cc1
Show InChI InChI=1S/C27H32N2O/c30-27(18-22-6-2-1-3-7-22)29-19-24-12-13-25(26(24)20-29)23-10-8-21(9-11-23)14-17-28-15-4-5-16-28/h1-3,6-11,13,24,26H,4-5,12,14-20H2/t24-,26+/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
7n/an/an/an/an/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement of N-[3H]methylhistamine from histamine H3 receptor in rat cortex membrane


Bioorg Med Chem Lett 18: 4133-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.086
BindingDB Entry DOI: 10.7270/Q2C82942
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50242844
PNG
((3aR,6aR)-N,N-dimethyl-6-(4-(2-(pyrrolidin-1-yl)et...)
Show SMILES CN(C)C(=O)N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCCC2)cc1
Show InChI InChI=1S/C22H31N3O/c1-23(2)22(26)25-15-19-9-10-20(21(19)16-25)18-7-5-17(6-8-18)11-14-24-12-3-4-13-24/h5-8,10,19,21H,3-4,9,11-16H2,1-2H3/t19-,21+/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
13n/an/an/an/an/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement of N-[3H]methylhistamine from histamine H3 receptor in rat cortex membrane


Bioorg Med Chem Lett 18: 4133-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.086
BindingDB Entry DOI: 10.7270/Q2C82942
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50242843
PNG
((3aR,6aR)-N-cyclopentyl-6-(4-(2-(pyrrolidin-1-yl)e...)
Show SMILES O=C(NC1CCCC1)N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCCC2)cc1
Show InChI InChI=1S/C25H35N3O/c29-25(26-22-5-1-2-6-22)28-17-21-11-12-23(24(21)18-28)20-9-7-19(8-10-20)13-16-27-14-3-4-15-27/h7-10,12,21-22,24H,1-6,11,13-18H2,(H,26,29)/t21-,24+/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
16n/an/an/an/an/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement of N-[3H]methylhistamine from histamine H3 receptor in rat cortex membrane


Bioorg Med Chem Lett 18: 4133-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.086
BindingDB Entry DOI: 10.7270/Q2C82942
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50242842
PNG
((3aR,6aR)-N-isopropyl-6-(4-(2-(pyrrolidin-1-yl)eth...)
Show SMILES CC(C)NC(=O)N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCCC2)cc1
Show InChI InChI=1S/C23H33N3O/c1-17(2)24-23(27)26-15-20-9-10-21(22(20)16-26)19-7-5-18(6-8-19)11-14-25-12-3-4-13-25/h5-8,10,17,20,22H,3-4,9,11-16H2,1-2H3,(H,24,27)/t20-,22+/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
20n/an/an/an/an/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement of N-[3H]methylhistamine from histamine H3 receptor in rat cortex membrane


Bioorg Med Chem Lett 18: 4133-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.086
BindingDB Entry DOI: 10.7270/Q2C82942
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50232345
PNG
(CHEMBL4074726)
Show SMILES C(c1nc2ccccc2[nH]1)c1nnc(o1)-c1ccccn1
Show InChI InChI=1S/C15H11N5O/c1-2-6-11-10(5-1)17-13(18-11)9-14-19-20-15(21-14)12-7-3-4-8-16-12/h1-8H,9H2,(H,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7.35E+4n/an/an/an/an/an/a



Hamdard University

Curated by ChEMBL


Assay Description
Inhibition of EGF induced EGFR phosphorylation in human KB cells preincubated for 90 mins followed by EGF addition for 5 mins by sandwich ELISA metho...


Eur J Med Chem 126: 853-869 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.014
More data for this
Ligand-Target Pair
G-protein coupled receptor 39


(Homo sapiens (Human))
BDBM50232365
PNG
(CHEMBL4087979)
Show SMILES CCCCCCCCOC1CC(=O)Nc2c1c(C)nn2-c1ncnc2nc[nH]c12
Show InChI InChI=1S/C20H27N7O2/c1-3-4-5-6-7-8-9-29-14-10-15(28)25-19-16(14)13(2)26-27(19)20-17-18(22-11-21-17)23-12-24-20/h11-12,14H,3-10H2,1-2H3,(H,25,28)(H,21,22,23,24)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 388n/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Agonist activity at human GPR39 expressed in HEK293 cells co-expressing Galphaq assessed as myo-[2-3H]inositol phosphate accumulation measured after ...


J Med Chem 60: 886-898 (2017)


Article DOI: 10.1021/acs.jmedchem.6b00648
More data for this
Ligand-Target Pair
G-protein coupled receptor 39


(Homo sapiens (Human))
BDBM50232366
PNG
(CHEMBL4065636)
Show SMILES Cc1nn(c2NC(=O)CC(c12)c1ccc(COc2cccc(Cl)c2)cc1)-c1nc(C)cc(C)n1
Show InChI InChI=1S/C26H24ClN5O2/c1-15-11-16(2)29-26(28-15)32-25-24(17(3)31-32)22(13-23(33)30-25)19-9-7-18(8-10-19)14-34-21-6-4-5-20(27)12-21/h4-12,22H,13-14H2,1-3H3,(H,30,33)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 3.00E+3n/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Agonist activity at human GPR39 expressed in HEK293 cells co-expressing Galphaq assessed as myo-[2-3H]inositol phosphate accumulation measured after ...


J Med Chem 60: 886-898 (2017)


Article DOI: 10.1021/acs.jmedchem.6b00648
More data for this
Ligand-Target Pair
G-protein coupled receptor 39


(Homo sapiens (Human))
BDBM50232365
PNG
(CHEMBL4087979)
Show SMILES CCCCCCCCOC1CC(=O)Nc2c1c(C)nn2-c1ncnc2nc[nH]c12
Show InChI InChI=1S/C20H27N7O2/c1-3-4-5-6-7-8-9-29-14-10-15(28)25-19-16(14)13(2)26-27(19)20-17-18(22-11-21-17)23-12-24-20/h11-12,14H,3-10H2,1-2H3,(H,25,28)(H,21,22,23,24)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 8n/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Agonist activity at human GPR39 expressed in HEK293 cells co-expressing Galphaq assessed as myo-[2-3H]inositol phosphate accumulation in presence of ...


J Med Chem 60: 886-898 (2017)


Article DOI: 10.1021/acs.jmedchem.6b00648
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50232345
PNG
(CHEMBL4074726)
Show SMILES C(c1nc2ccccc2[nH]1)c1nnc(o1)-c1ccccn1
Show InChI InChI=1S/C15H11N5O/c1-2-6-11-10(5-1)17-13(18-11)9-14-19-20-15(21-14)12-7-3-4-8-16-12/h1-8H,9H2,(H,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7.35E+4n/an/an/an/an/an/a



Hamdard University

Curated by ChEMBL


Assay Description
Inhibition of EGF induced EGFR phosphorylation in human KB cells preincubated for 90 mins followed by EGF addition for 5 mins by sandwich ELISA metho...


Eur J Med Chem 126: 853-869 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.014
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM50232351
PNG
(CHEMBL4100664)
Show SMILES CN(C)Cc1c(C)n(Cc2ccc(cc2)C(=O)NO)c2ccccc12
Show InChI InChI=1S/C20H23N3O2/c1-14-18(13-22(2)3)17-6-4-5-7-19(17)23(14)12-15-8-10-16(11-9-15)20(24)21-25/h4-11,25H,12-13H2,1-3H3,(H,21,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1n/an/an/an/an/an/a



Taipei Medical University

Curated by ChEMBL


Assay Description
Inhibition of full length human recombinant C-terminal GST-tagged HDAC2 expressed in insect cells using RHKK(Ac) as substrate after 60 mins by fluori...


Eur J Med Chem 127: 115-127 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.039
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50232351
PNG
(CHEMBL4100664)
Show SMILES CN(C)Cc1c(C)n(Cc2ccc(cc2)C(=O)NO)c2ccccc12
Show InChI InChI=1S/C20H23N3O2/c1-14-18(13-22(2)3)17-6-4-5-7-19(17)23(14)12-15-8-10-16(11-9-15)20(24)21-25/h4-11,25H,12-13H2,1-3H3,(H,21,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 9.70n/an/an/an/an/an/a



Taipei Medical University

Curated by ChEMBL


Assay Description
Inhibition of full length human recombinant C-terminal FLAG-His-tagged HDAC1 expressed in Sf21 cells using RHKK(Ac) as substrate after 60 mins by flu...


Eur J Med Chem 127: 115-127 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.039
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50232351
PNG
(CHEMBL4100664)
Show SMILES CN(C)Cc1c(C)n(Cc2ccc(cc2)C(=O)NO)c2ccccc12
Show InChI InChI=1S/C20H23N3O2/c1-14-18(13-22(2)3)17-6-4-5-7-19(17)23(14)12-15-8-10-16(11-9-15)20(24)21-25/h4-11,25H,12-13H2,1-3H3,(H,21,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.20n/an/an/an/an/an/a



Taipei Medical University

Curated by ChEMBL


Assay Description
Inhibition of full length human recombinant N-terminal GST-tagged HDAC6 expressed in Sf9 cells using RHKK(Ac) as substrate after 90 mins by fluorimet...


Eur J Med Chem 127: 115-127 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.039
More data for this
Ligand-Target Pair