Carnitine

Carnitine

SCHEMBL28052222

CCc1ccc(C(=O)Cl)cc1.C[N+](C)(C)CC(O)CC(=O)[O-]

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A16 Q86VW1 1/20 0.56
ALDH1A1 P00352 3/20 0.40
CPT2 P23786 1/20 0.38
CPT1A P50416 1/20 0.38
PLK1 P53350 1/20 0.37
MAPT P10636 1/20 0.37
CYP2C19 P33261 2/20 0.36
CYP2C9 P11712 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
RECQL P46063 1/20 0.36
AKR1C3 P42330 1/20 0.36
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CYP1A2 P05177 1/20 0.35
HRH1 P35367 1/20 0.35
CRAT P43155 1/20 0.35
TDP1 Q9NUW8 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Carnitine SCHEMBL28825997 0.84 SLC22A16 (0.61) SLC22A16ALDH1A1CPT2CPT1AMAPT
SCHEMBL526436 0.76 ALDH1A1 (0.64) ALDH1A1PLK1MAPTCYP2C19CYP2C9
Levocarnitine SCHEMBL2638845 0.75 SLC22A16 (0.77) SLC22A16CPT2CPT1AMAPTCYP2C19
Carnitine SCHEMBL29106450 0.75 SLC22A16 (0.83) SLC22A16CPT2CPT1AMAPTCYP2C19
Carnitine SCHEMBL10491715 0.75 SLC22A16 (0.83) SLC22A16CPT2CPT1AMAPTCYP2C19
Levocarnitine SCHEMBL2639480 0.75 SLC22A16 (0.83) SLC22A16CPT2CPT1AMAPTCYP2C19
Levocarnitine SCHEMBL21970 0.74 SLC22A16 (1.00) SLC22A16CPT2CPT1AMAPTCYP2C19
D-Carnitine SCHEMBL94286 0.74 SLC22A16 (1.00) SLC22A16CPT2CPT1AMAPTCYP2C19
Carnitine SCHEMBL3902633 0.74 SLC22A16 (1.00) SLC22A16CPT2CPT1AMAPTCYP2C19
Carnitine SCHEMBL21971 0.74 SLC22A16 (1.00) SLC22A16CPT2CPT1AMAPTCYP2C19

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105424828-B The method of enantiomter content in detection levocarnitine 山东齐都药业有限公司 2017-06-13 CN disclosed
CN-105424828-A Method for detecting content of enantiomer in levocarnitine SHANDONG QIDU PHARMACEUTICAL 2016-03-23 CN disclosed