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BDBM264093 3-(4-(4-(4-(3-oxomorpholino)phenyl)piperazin-1-yl)butyl)-1H-indole-5-carbonitrile::US9714232, 6

SMILES: O=C1COCCN1c1ccc(cc1)N1CCN(CCCCc2c[nH]c3ccc(cc23)C#N)CC1

InChI Key: InChIKey=LUWTVLKXBDOFGN-UHFFFAOYSA-N

Data: 1 KI  1 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 2 hits for monomerid = 264093   
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
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM264093
PNG
(3-(4-(4-(4-(3-oxomorpholino)phenyl)piperazin-1-yl)...)
Show SMILES O=C1COCCN1c1ccc(cc1)N1CCN(CCCCc2c[nH]c3ccc(cc23)C#N)CC1
Show InChI InChI=1S/C27H31N5O2/c28-18-21-4-9-26-25(17-21)22(19-29-26)3-1-2-10-30-11-13-31(14-12-30)23-5-7-24(8-6-23)32-15-16-34-20-27(32)33/h4-9,17,19,29H,1-3,10-16,20H2
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
2.10n/an/an/an/an/an/a7.4n/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Human HEK-293 cell homogenates (36 μg protein) were incubated at 22° C. for 60 minutes with 0.3 nM [3H]8-0H-DPAT (Perkin-Elmer) in the absence o...


US Patent US9714232 (2017)


BindingDB Entry DOI: 10.7270/Q28054N5
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM264093
PNG
(3-(4-(4-(4-(3-oxomorpholino)phenyl)piperazin-1-yl)...)
Show SMILES O=C1COCCN1c1ccc(cc1)N1CCN(CCCCc2c[nH]c3ccc(cc23)C#N)CC1
Show InChI InChI=1S/C27H31N5O2/c28-18-21-4-9-26-25(17-21)22(19-29-26)3-1-2-10-30-11-13-31(14-12-30)23-5-7-24(8-6-23)32-15-16-34-20-27(32)33/h4-9,17,19,29H,1-3,10-16,20H2
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 2.20n/an/an/an/a7.4n/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
The synaptosomes (150 μg) prepared from a rat brain were incubated at 37° C. for 15 minutes with 0.1 μCi [3H]5-HT in the absence or presenc...


US Patent US9714232 (2017)


BindingDB Entry DOI: 10.7270/Q28054N5
More data for this
Ligand-Target Pair