Acetylcarnitine

Acetylcarnitine

SCHEMBL2515409

CC(=O)O[C@H](CC(=O)O)C[N+](C)(C)C.[Ca+2]

nearest known ligand 0.93

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Known targets — ChEMBL curated mechanism

GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHMGCRMMP1MMP13MMP7MMP8PTGS1PTGS2ileSpolrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Acetylcarnitine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.93
SMN1; SMN2 Q16637 2/20 0.93
CYP1A2 P05177 4/20 0.68
MEN1 O00255 4/20 0.68
KMT2A Q03164 4/20 0.68
HRH1 P35367 1/20 0.68
MAPT P10636 5/20 0.55
MAPK1 P28482 4/20 0.55
GMNN O75496 3/20 0.55
NPSR1 Q6W5P4 3/20 0.55
BLM P54132 3/20 0.55
HSP90AA1 P07900 2/20 0.55
NR1H4 Q96RI1 2/20 0.55
TSHR P16473 2/20 0.55
TP53 P04637 1/20 0.55
CYP2C9 P11712 1/20 0.55
HIF1A Q16665 1/20 0.55
GLA P06280 1/20 0.54
PMP22 Q01453 1/20 0.54
CHRM2 P08172 1/20 0.52

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
Acetylcarnitine SCHEMBL4749513 1.00 LMNA (0.93) LMNASMN1; SMN2CYP1A2MEN1KMT2A
Acetylcarnitine SCHEMBL13323920 0.98 LMNA (0.96) LMNASMN1; SMN2CYP1A2MEN1KMT2A
Acetylcarnitine SCHEMBL7079427 0.98 LMNA (0.96) LMNASMN1; SMN2CYP1A2MEN1KMT2A
Acetylcarnitine SCHEMBL3259109 0.98 LMNA (0.96) LMNASMN1; SMN2CYP1A2MEN1KMT2A
Acetylcarnitine SCHEMBL3004012 0.96 LMNA (0.93) LMNASMN1; SMN2CYP1A2MEN1KMT2A
Acetylcarnitine SCHEMBL2639482 0.96 LMNA (1.00) LMNASMN1; SMN2CYP1A2MEN1KMT2A
Acetylcarnitine SCHEMBL20721036 0.96 LMNA (0.93) LMNASMN1; SMN2CYP1A2MEN1KMT2A
Acetylcarnitine SCHEMBL28744378 0.96 LMNA (0.93) LMNASMN1; SMN2CYP1A2MEN1KMT2A
Acetylcarnitine SCHEMBL29376874 0.96 LMNA (1.00) LMNASMN1; SMN2CYP1A2MEN1KMT2A
Acetylcarnitine SCHEMBL27571008 0.96 LMNA (0.93) LMNASMN1; SMN2CYP1A2MEN1KMT2A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8034833-B2 Phosphorus binder for treatment of renal disease BIOLINK LIFE SCIENCES, INC. (US) 2011-10-11 US disclosed
US-20090239914-A1 Phosphorus binder for treatment of renal disease BIOLINK LIFE SCIENCES, INC. 2009-09-24 US disclosed
US-7572832-B2 Non-hygroscopic L-carnitine salts BIOLINK LIFE SCIENCES, INC. (US) 2009-08-11 US disclosed
US-20080234371-A1 Non-hygroscopic L-carnitine salts BIOLINK LIFE SCIENCES, INC. 2008-09-25 US disclosed
WO-2008116215-A2 PHOSPHORUS BINDER FOR TREATMENT OF RENAL DISEASE BIOLINK LIFE SCIENCES, INC. (US) 2008-09-25 WO disclosed
WO-2008115915-A2 NON-HYGROSCOPIC L-CARNITINE SALTS BIOLINK LIFE SCIENCES, INC. (US) 2008-09-25 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090239914-A1 Phosphorus binder for treatment of renal disease ALPI, PHPT1, FABP2 LMNA 3581/4885SMN1; SMN2 4282/4885CYP1A2 3238/4885
US-20080234371-A1 Non-hygroscopic L-carnitine salts CRAT, SLC25A20, CPT1B LMNA 420/4885SMN1; SMN2 998/4885CYP1A2 2226/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.