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BDBM50190653 CHEMBL3959689

SMILES: [H][C@@]12[C@@H](OC(C)=O)[C@]3(OC1(C)C)[C@H](C)CC[C@H](OC(C)=O)[C@@]3(C)[C@H](OC(=O)c1ccccc1)[C@@H]2OC(C)=O

InChI Key: InChIKey=ZFYHVMQCJIKTLP-OTOYSWGPSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50190653   
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
Large neutral amino acids transporter small subunit 3


(Homo sapiens (Human))		BDBM50190653
PNG
(CHEMBL3959689)
Show SMILES [H][C@@]12[C@@H](OC(C)=O)[C@]3(OC1(C)C)[C@H](C)CC[C@H](OC(C)=O)[C@@]3(C)[C@H](OC(=O)c1ccccc1)[C@@H]2OC(C)=O |r|
Show InChI InChI=1S/C28H36O9/c1-15-13-14-20(33-16(2)29)27(7)24(36-25(32)19-11-9-8-10-12-19)22(34-17(3)30)21-23(35-18(4)31)28(15,27)37-26(21,5)6/h8-12,15,20-24H,13-14H2,1-7H3/t15-,20+,21-,22-,23-,24-,27+,28-/m1/s1
UniProtKB/SwissProt
UniProtKB/TrEMBL

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PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 1.55E+4n/an/an/an/an/an/a



Griffith University

Curated by ChEMBL


Assay Description
Inhibition of LAT3 in human LNCAP cells assessed as inhibition of [3H]L-leucine uptake after 15 mins by liquid scintillation counting method

J Nat Prod 79: 1445-53 (2016)


BindingDB Entry DOI: 10.7270/Q2N29ZWV
More data for this
Ligand-Target Pair