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Found 1 hit Enz. Inhib. hit(s) with Target = 'Sarcoplasmic/endoplasmic reticulum calcium ATPase 1' and Ligand = 'BDBM50097525'   
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
Sarcoplasmic/endoplasmic reticulum calcium ATPase 1


(Oryctolagus cuniculus)		BDBM50097525
PNG
(CHEMBL3586099)
Show SMILES [H][C@@]12C[C@@H](OC)C=C3[C@@H](O)O[C@@H](O)[C@@]13[C@@H](O)[C@H](O)[C@@H](C)[C@@]2(C)C\C=C(/C)C=C |r,t:6|
Show InChI InChI=1S/C21H32O6/c1-6-11(2)7-8-20(4)12(3)16(22)17(23)21-14(18(24)27-19(21)25)9-13(26-5)10-15(20)21/h6-7,9,12-13,15-19,22-25H,1,8,10H2,2-5H3/b11-7+/t12-,13+,15+,16-,17+,18+,19-,20-,21-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/an/a>1.00E+5n/an/an/an/an/a



Albert Ludwigs University Freiburg

Curated by ChEMBL


Assay Description
Binding affinity to rabbit skeletal muscle SERCA1a preincubated for 5 mins followed by Mg-ATP addition measured over 6 mins by spectrophotometric ana...

J Nat Prod 78: 1262-70 (2015)


Article DOI: 10.1021/acs.jnatprod.5b00062
BindingDB Entry DOI: 10.7270/Q2833TR2
More data for this
Ligand-Target Pair