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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 435.5
BDBM76806
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Voltage-dependent T-type calcium channel subunit alpha-1H


(Homo sapiens (Human))
BDBM76806
PNG
(MLS000027319 | N-(2,3-Dihydro-benzo[1,4]dioxin-6-y...)
Show SMILES CCCn1c(nc2ccccc12)N1CCN(CC(=O)Nc2ccc3OCCOc3c2)CC1
Show InChI InChI=1S/C24H29N5O3/c1-2-9-29-20-6-4-3-5-19(20)26-24(29)28-12-10-27(11-13-28)17-23(30)25-18-7-8-21-22(16-18)32-15-14-31-21/h3-8,16H,2,9-15,17H2,1H3,(H,25,30)
PDB

UniProtKB/SwissProt

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AffyNet 
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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 3.84E+3n/an/an/an/a



Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters

Curated by PubChem BioAssay


Assay Description
Assay Provider: Xinmin Xie Assay Provider Affiliation: Bioscience Division, SRI International, Menlo Park, CA Grant Title: HTS Assay for Cav3 T-Type ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2B856KG
More data for this
Ligand-Target Pair