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Compile Data Set for Download or QSAR

Found 1 hit of ec50 data for polymerid = 50006424   
Target
(Institution)
LigandTarget
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
Niemann-Pick C1 protein


(Homo sapiens)
BDBM50439730
PNG
(CHEMBL2418982)
Show SMILES C[C@H](CCC(=O)N(C)C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)N(CCO)CCO
Show InChI InChI=1S/C31H52N2O5/c1-21(6-11-28(36)32(4)5)25-9-10-26-24-8-7-22-20-23(38-29(37)33(16-18-34)17-19-35)12-14-30(22,2)27(24)13-15-31(25,26)3/h7,21,23-27,34-35H,6,8-20H2,1-5H3/t21-,23+,24+,25-,26+,27+,30+,31-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/an/an/a 1.60E+3n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Binding affinity to NPC1 (unknown origin)


Bioorg Med Chem 21: 5297-309 (2013)

More data for this
Ligand-Target Pair