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BDBM312212 US9604926, Compound CM-624::US9724435, Compound CM624

SMILES: Fc1ccc(N2CCN(CCCCn3c4ccccc4oc3=O)CC2)c(F)c1

InChI Key: InChIKey=DDIWZITUFBYTBP-UHFFFAOYSA-N

Data: 4 KI

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 = 312212   
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
Sigma-2 receptor


(Rattus norvegicus (Rat))
BDBM312212
PNG
(US9604926, Compound CM-624 | US9724435, Compound C...)
Show SMILES Fc1ccc(N2CCN(CCCCn3c4ccccc4oc3=O)CC2)c(F)c1
Show InChI InChI=1S/C21H23F2N3O2/c22-16-7-8-18(17(23)15-16)25-13-11-24(12-14-25)9-3-4-10-26-19-5-1-2-6-20(19)28-21(26)27/h1-2,5-8,15H,3-4,9-14H2
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
1.96n/an/an/an/an/an/an/an/a



THE UNIVERSITY OF MISSISSIPPI; THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY

US Patent


Assay Description
Compounds were evaluated for σ-1 and σ-2 binding in rat brain homogenates. Twelve concentrations of each test ligand (0.001-1,000 nM) were ...


US Patent US9724435 (2017)


BindingDB Entry DOI: 10.7270/Q2BZ6856
More data for this
Ligand-Target Pair
Sigma intracellular receptor 2


(Mus musculus (Mouse))
BDBM312212
PNG
(US9604926, Compound CM-624 | US9724435, Compound C...)
Show SMILES Fc1ccc(N2CCN(CCCCn3c4ccccc4oc3=O)CC2)c(F)c1
Show InChI InChI=1S/C21H23F2N3O2/c22-16-7-8-18(17(23)15-16)25-13-11-24(12-14-25)9-3-4-10-26-19-5-1-2-6-20(19)28-21(26)27/h1-2,5-8,15H,3-4,9-14H2
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
1.96n/an/an/an/an/an/an/an/a



THE UNIVERSITY OF MISSISSIPPI

US Patent


Assay Description
Compounds were evaluated for σ-1 and σ-2 binding in rat brain homogenates. Twelve concentrations of each test ligand (0.001-1,000 nM) were ...


US Patent US9604926 (2017)


BindingDB Entry DOI: 10.7270/Q27D2X6J
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Mus musculus (Mouse))
BDBM312212
PNG
(US9604926, Compound CM-624 | US9724435, Compound C...)
Show SMILES Fc1ccc(N2CCN(CCCCn3c4ccccc4oc3=O)CC2)c(F)c1
Show InChI InChI=1S/C21H23F2N3O2/c22-16-7-8-18(17(23)15-16)25-13-11-24(12-14-25)9-3-4-10-26-19-5-1-2-6-20(19)28-21(26)27/h1-2,5-8,15H,3-4,9-14H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
14.8n/an/an/an/an/an/an/an/a



THE UNIVERSITY OF MISSISSIPPI

US Patent


Assay Description
Compounds were evaluated for σ-1 and σ-2 binding in rat brain homogenates. Twelve concentrations of each test ligand (0.001-1,000 nM) were ...


US Patent US9604926 (2017)


BindingDB Entry DOI: 10.7270/Q27D2X6J
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)
BDBM312212
PNG
(US9604926, Compound CM-624 | US9724435, Compound C...)
Show SMILES Fc1ccc(N2CCN(CCCCn3c4ccccc4oc3=O)CC2)c(F)c1
Show InChI InChI=1S/C21H23F2N3O2/c22-16-7-8-18(17(23)15-16)25-13-11-24(12-14-25)9-3-4-10-26-19-5-1-2-6-20(19)28-21(26)27/h1-2,5-8,15H,3-4,9-14H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
14.8n/an/an/an/an/an/an/an/a



THE UNIVERSITY OF MISSISSIPPI; THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY

US Patent


Assay Description
Compounds were evaluated for σ-1 and σ-2 binding in rat brain homogenates. Twelve concentrations of each test ligand (0.001-1,000 nM) were ...


US Patent US9724435 (2017)


BindingDB Entry DOI: 10.7270/Q2BZ6856
More data for this
Ligand-Target Pair