BindingDB logo
myBDB logout

4 similar compounds to monomer 50220749

Compile data set for download or QSAR
Wt: 307.3
BDBM50220740
Wt: 303.3
BDBM50220741
Wt: 480.4
BDBM50220745
Wt: 224.3
BDBM50220738

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50220740,50220741,50220745,50220738   
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
Adrenergic receptor alpha


(Homo sapiens (Human))
BDBM50220745
PNG
(CHEMBL301650)
Show SMILES FC(F)(F)COc1ccccc1N1CCN(CCCn2c(=O)[nH]cc(c2=O)C(F)(F)F)CC1
Show InChI InChI=1S/C20H22F6N4O3/c21-19(22,23)13-33-16-5-2-1-4-15(16)29-10-8-28(9-11-29)6-3-7-30-17(31)14(20(24,25)26)12-27-18(30)32/h1-2,4-5,12H,3,6-11,13H2,(H,27,32)
UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
6.30n/an/an/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibition of [3H]prazosin binding to CHO-K1 whole cells expressing human cloned Alpha-1B adrenergic receptor


Bioorg Med Chem Lett 13: 1873-8 (2003)


Article DOI: 10.1016/s0960-894x(03)00305-6
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Homo sapiens (Human))
BDBM50220745
PNG
(CHEMBL301650)
Show SMILES FC(F)(F)COc1ccccc1N1CCN(CCCn2c(=O)[nH]cc(c2=O)C(F)(F)F)CC1
Show InChI InChI=1S/C20H22F6N4O3/c21-19(22,23)13-33-16-5-2-1-4-15(16)29-10-8-28(9-11-29)6-3-7-30-17(31)14(20(24,25)26)12-27-18(30)32/h1-2,4-5,12H,3,6-11,13H2,(H,27,32)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

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



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibition of [3H]prazosin binding to CHO-K1 whole cells expressing human cloned Alpha-1A adrenergic receptor


Bioorg Med Chem Lett 13: 1873-8 (2003)


Article DOI: 10.1016/s0960-894x(03)00305-6
More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50220738
PNG
(CHEMBL48967)
Show SMILES Cc1cc(ccn1)N1CCc2ccccc2C1
Show InChI InChI=1S/C15H16N2/c1-12-10-15(6-8-16-12)17-9-7-13-4-2-3-5-14(13)11-17/h2-6,8,10H,7,9,11H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
5.70E+3n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Binding affinity towards alpha receptor in rat brain using [3H]prazosin as radioligand


Bioorg Med Chem Lett 13: 1759-62 (2003)


Article DOI: 10.1016/s0960-894x(03)00232-4
BindingDB Entry DOI: 10.7270/Q2513XKF
More data for this
Ligand-Target Pair
Hdac5 protein


(Rattus norvegicus)
BDBM50220740
PNG
(CHEMBL55974)
Show SMILES C[C@H](CCCCC(=O)NO)NC(=O)c1ccc(cc1)N(C)C
Show InChI InChI=1S/C16H25N3O3/c1-12(6-4-5-7-15(20)18-22)17-16(21)13-8-10-14(11-9-13)19(2)3/h8-12,22H,4-7H2,1-3H3,(H,17,21)(H,18,20)/t12-/m1/s1
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 359n/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Inhibitory activity against histone deacetylase (HDAC)


Bioorg Med Chem Lett 13: 1861-4 (2003)


Article DOI: 10.1016/s0960-894x(03)00284-1
More data for this
Ligand-Target Pair
Hdac5 protein


(Rattus norvegicus)
BDBM50220741
PNG
(CHEMBL417594)
Show SMILES C[C@@H](NC(=O)c1ccc(cc1)N(C)C)\C=C\C=C\C(=O)NO
Show InChI InChI=1S/C16H21N3O3/c1-12(6-4-5-7-15(20)18-22)17-16(21)13-8-10-14(11-9-13)19(2)3/h4-12,22H,1-3H3,(H,17,21)(H,18,20)/b6-4+,7-5+/t12-/m1/s1
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.22E+4n/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Inhibitory activity against histone deacetylase (HDAC)


Bioorg Med Chem Lett 13: 1861-4 (2003)


Article DOI: 10.1016/s0960-894x(03)00284-1
More data for this
Ligand-Target Pair