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Compile Data Set for Download or QSAR

Found 1 hit for UniProtKB: P97823   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Acyl-protein thioesterase 1/2


(Mus musculus)		BDBM50547463
PNG
(CHEMBL4778420)
Show SMILES NC(=O)[C@H](CCCCN=[N+]=[N-])NC(=O)CCCCCNC(=O)[C@H](Cc1ccccc1)NC(=O)C1CCN(CC1)C(=O)n1ccnn1
Show InChI InChI=1S/C30H43N11O5/c31-27(43)24(11-6-8-16-34-38-32)36-26(42)12-5-2-7-15-33-29(45)25(21-22-9-3-1-4-10-22)37-28(44)23-13-18-40(19-14-23)30(46)41-20-17-35-39-41/h1,3-4,9-10,17,20,23-25H,2,5-8,11-16,18-19,21H2,(H2,31,43)(H,33,45)(H,36,42)(H,37,44)/t24-,25-/m0/s1
UniProtKB/SwissProt

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PC cid
PC sid
UniChem
PubMed
n/an/a 460n/an/an/an/an/an/a



KU Leuven

Curated by ChEMBL


Assay Description
Inhibition of FP-Rh binding to APT-1/2 in mouse brain cytosolic fraction preincubated for 1 hr followed by FP-Rh addition and measured after 1 hr by ...

J Med Chem 63: 11845-11853 (2020)

More data for this
Ligand-Target Pair