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BDBM128235 2,5-bis[(dimethylamino)methyl]-1,1,6,6-tetraphenyl-hexane-1,6-diol::2,5-bis[(dimethylamino)methyl]-1,1,6,6-tetraphenylhexane-1,6-diol::MLS001173677::SMR000538747::cid_3781244

SMILES: CN(C)CC(CCC(CN(C)C)C(O)(c1ccccc1)c1ccccc1)C(O)(c1ccccc1)c1ccccc1

InChI Key: InChIKey=KFEZGJFTVICLIJ-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

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 = 128235   
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
Transthyretin


(Homo sapiens (Human))
BDBM128235
PNG
(2,5-bis[(dimethylamino)methyl]-1,1,6,6-tetraphenyl...)
Show SMILES CN(C)CC(CCC(CN(C)C)C(O)(c1ccccc1)c1ccccc1)C(O)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C36H44N2O2/c1-37(2)27-33(35(39,29-17-9-5-10-18-29)30-19-11-6-12-20-30)25-26-34(28-38(3)4)36(40,31-21-13-7-14-22-31)32-23-15-8-16-24-32/h5-24,33-34,39-40H,25-28H2,1-4H3
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a>1.67E+5n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q2DN43RH
More data for this
Ligand-Target Pair
Transthyretin


(Homo sapiens (Human))
BDBM128235
PNG
(2,5-bis[(dimethylamino)methyl]-1,1,6,6-tetraphenyl...)
Show SMILES CN(C)CC(CCC(CN(C)C)C(O)(c1ccccc1)c1ccccc1)C(O)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C36H44N2O2/c1-37(2)27-33(35(39,29-17-9-5-10-18-29)30-19-11-6-12-20-30)25-26-34(28-38(3)4)36(40,31-21-13-7-14-22-31)32-23-15-8-16-24-32/h5-24,33-34,39-40H,25-28H2,1-4H3
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.72E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q2JD4VGV
More data for this
Ligand-Target Pair