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BDBM50249783 10-(6-(diethylamino)hexyl)acridin-9(10H)-one::CHEMBL491889::KF-A6

SMILES: CCN(CC)CCCCCCn1c2ccccc2c(=O)c2ccccc12

InChI Key: InChIKey=YHXSELHUXJAOLR-UHFFFAOYSA-N

Data: 4 IC50

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 4 hits for monomerid = 50249783   
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
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM50249783
PNG
(10-(6-(diethylamino)hexyl)acridin-9(10H)-one | CHE...)
Show SMILES CCN(CC)CCCCCCn1c2ccccc2c(=O)c2ccccc12
Show InChI InChI=1S/C23H30N2O/c1-3-24(4-2)17-11-5-6-12-18-25-21-15-9-7-13-19(21)23(26)20-14-8-10-16-22(20)25/h7-10,13-16H,3-6,11-12,17-18H2,1-2H3
NCI pathway
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Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Veterans Affairs Medical Center

Curated by ChEMBL


Assay Description
Inhibition of [3H]dopamine uptake at human DAT expressed in HEK293 cells


Antimicrob Agents Chemother 51: 4133-40 (2007)


Article DOI: 10.1128/AAC.00669-07
BindingDB Entry DOI: 10.7270/Q2FT8MZZ
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))
BDBM50249783
PNG
(10-(6-(diethylamino)hexyl)acridin-9(10H)-one | CHE...)
Show SMILES CCN(CC)CCCCCCn1c2ccccc2c(=O)c2ccccc12
Show InChI InChI=1S/C23H30N2O/c1-3-24(4-2)17-11-5-6-12-18-25-21-15-9-7-13-19(21)23(26)20-14-8-10-16-22(20)25/h7-10,13-16H,3-6,11-12,17-18H2,1-2H3
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Article
PubMed
n/an/a 3.60E+3n/an/an/an/an/an/a



Veterans Affairs Medical Center

Curated by ChEMBL


Assay Description
Displacement of [3H]pyrilamine from human histamine receptor subtype 1 expressed in CHO cells


Antimicrob Agents Chemother 51: 4133-40 (2007)


Article DOI: 10.1128/AAC.00669-07
BindingDB Entry DOI: 10.7270/Q2FT8MZZ
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50249783
PNG
(10-(6-(diethylamino)hexyl)acridin-9(10H)-one | CHE...)
Show SMILES CCN(CC)CCCCCCn1c2ccccc2c(=O)c2ccccc12
Show InChI InChI=1S/C23H30N2O/c1-3-24(4-2)17-11-5-6-12-18-25-21-15-9-7-13-19(21)23(26)20-14-8-10-16-22(20)25/h7-10,13-16H,3-6,11-12,17-18H2,1-2H3
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Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Veterans Affairs Medical Center

Curated by ChEMBL


Assay Description
Inhibition of [3H]norepinephrine uptake at human NET expressed in HEK293 cells


Antimicrob Agents Chemother 51: 4133-40 (2007)


Article DOI: 10.1128/AAC.00669-07
BindingDB Entry DOI: 10.7270/Q2FT8MZZ
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50249783
PNG
(10-(6-(diethylamino)hexyl)acridin-9(10H)-one | CHE...)
Show SMILES CCN(CC)CCCCCCn1c2ccccc2c(=O)c2ccccc12
Show InChI InChI=1S/C23H30N2O/c1-3-24(4-2)17-11-5-6-12-18-25-21-15-9-7-13-19(21)23(26)20-14-8-10-16-22(20)25/h7-10,13-16H,3-6,11-12,17-18H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

DrugBank
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CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 3.50E+3n/an/an/an/an/an/a



Veterans Affairs Medical Center

Curated by ChEMBL


Assay Description
Inhibition of [3H]5HT uptake at human SERT expressed in HEK293 cells


Antimicrob Agents Chemother 51: 4133-40 (2007)


Article DOI: 10.1128/AAC.00669-07
BindingDB Entry DOI: 10.7270/Q2FT8MZZ
More data for this
Ligand-Target Pair