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SMILES: [H][C@]12C[C@@H](CO)N(C1)c1cc(Nc3cc4CCC(=O)Nc4c(OCCCCO2)c3)n2nccc2n1

InChI Key: InChIKey=NPJLBTOWTCQVCX-ROUUACIJSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50239386   
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
Zinc finger and BTB domain-containing protein 16


(Homo sapiens)
BDBM50239386
PNG
(CHEMBL4083173)
Show SMILES [H][C@]12C[C@@H](CO)N(C1)c1cc(Nc3cc4CCC(=O)Nc4c(OCCCCO2)c3)n2nccc2n1 |r|
Show InChI InChI=1S/C24H28N6O4/c31-14-17-11-18-13-29(17)21-12-22(30-20(27-21)5-6-25-30)26-16-9-15-3-4-23(32)28-24(15)19(10-16)34-8-2-1-7-33-18/h5-6,9-10,12,17-18,26,31H,1-4,7-8,11,13-14H2,(H,28,32)/t17-,18-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>3.00E+4n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of GAL4 DNA binding domain fused PLZF BTB domain (unknown origin) expressed in HEK 293T/17 cells after 24 hrs by Bright-Glo luciferase cel...


J Med Chem 60: 4386-4402 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00359
BindingDB Entry DOI: 10.7270/Q2ZW1P1C
More data for this
Ligand-Target Pair
B-cell lymphoma 6 protein


(Homo sapiens)
BDBM50239386
PNG
(CHEMBL4083173)
Show SMILES [H][C@]12C[C@@H](CO)N(C1)c1cc(Nc3cc4CCC(=O)Nc4c(OCCCCO2)c3)n2nccc2n1 |r|
Show InChI InChI=1S/C24H28N6O4/c31-14-17-11-18-13-29(17)21-12-22(30-20(27-21)5-6-25-30)26-16-9-15-3-4-23(32)28-24(15)19(10-16)34-8-2-1-7-33-18/h5-6,9-10,12,17-18,26,31H,1-4,7-8,11,13-14H2,(H,28,32)/t17-,18-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Agonistic potency at alpha-1 adrenergic receptor for the amine-induced increase of phosphatidylinositol breakdown in synaptoneurosomes from guinea pi...


J Med Chem 60: 4386-4402 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00359
BindingDB Entry DOI: 10.7270/Q2ZW1P1C
More data for this
Ligand-Target Pair