Carnitine

Carnitine

SCHEMBL27486119

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

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1ACEACHEACVR1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALKAVPR1AAVPR2BCHEBCRCA2CACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCASRCCR5CDK4CDK6CFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNA3CHRNA7CHRNB1CHRNB4CHRNDCHRNECHRNGCOXFA4COXFA4L2CRBNCSF1RCUL4ACYP19A1DDB1DPP4DRD1DRD2DRD3DRD4EDNRAEGFREML4ERBB2ERBB4ESR1ESR2FGFR1FGFR3FLT1FLT3FLT4GAAGABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGHSRGLAGNRHRGPD2GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSTP1HCN4HCRTR1HCRTR2HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HRH2HRH3HSD11B1HSP90AA1HSP90AB1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IMPDH1IMPDH2ITGA2BITGB3ITKJAK1JAK2KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNJ2KCNJ3KCNJ5KCNK3KCNK9KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2KDRKITKLKB1LCKMMAOAMAOBMAPK14METMMP1MMP13MMP7MMP8MT-ND1MT-ND2MT-ND3MT-ND4MT-ND4LMT-ND5MT-ND6NDUFA1NDUFA10NDUFA11NDUFA12NDUFA13NDUFA2NDUFA3NDUFA5NDUFA6NDUFA7NDUFA8NDUFA9NDUFAB1NDUFAF1NDUFAF2NDUFAF3NDUFAF4NDUFB1NDUFB10NDUFB11NDUFB2NDUFB3NDUFB4NDUFB5NDUFB6NDUFB7NDUFB8NDUFB9NDUFC1NDUFC2NDUFS1NDUFS2NDUFS3NDUFS4NDUFS5NDUFS6NDUFS7NDUFS8NDUFV1NDUFV2NDUFV3NR3C1NS5ANTRK1NTRK2NTRK3ODC1OPRD1OPRK1OPRM1P2RY12PAHPARP1PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDE5APDE7APDE7BPDE8APDE8BPDGFRAPDGFRBPIK3CAPIK3CDPNPPOLA1POLA2POLD1POLD2POLD3POLD4POLEPOLE2POLE3PPARGPRIM1PRIM2PRKCAPRKCBPRKCDPRKCEPRKCGPRKCHPRKCIPRKCQPRKCZPRKD1PRKD3PTGS1PTGS2RBX1RENRETROCK1ROCK2RPE65RRM1RRM2RRM2BS1PR1S1PR2S1PR3S1PR4S1PR5SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC18A2SLC6A1SLC6A2SLC6A3SLC6A4SLC9A3SRCTACR1TOP1TOP2ATOP2BTTRTYMPdacAdacBdacCembAfolAftsIgyrAgyrBmrcAmrcBmrdAparCparEpolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HRH1 known ✓ P35367 1/20 0.36
▸ SLC22A16 Q86VW1 1/20 0.59
▸ GSR P00390 1/20 0.50
▸ CPT2 P23786 1/20 0.47
▸ CPT1A P50416 1/20 0.47
▸ MAPT P10636 1/20 0.42
▸ ARG2 P78540 4/20 0.38
▸ NOS1 P29475 3/20 0.38
▸ NOS2 P35228 3/20 0.38
▸ BLM P54132 1/20 0.38
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ NOS3 P29474 2/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CRAT P43155 1/20 0.36
▸ ARG1 P05089 3/20 0.36

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
Levocarnitine SCHEMBL6553881 0.94 GSR (0.59) SLC22A16GSRCPT2CPT1AMAPT
Carnitine SCHEMBL9901519 0.94 GSR (0.59) SLC22A16GSRCPT2CPT1AMAPT
Carnitine SCHEMBL9128766 0.94 GSR (0.59) SLC22A16GSRCPT2CPT1AMAPT
Carnitine SCHEMBL28276640 0.91 SLC22A16 (0.51) SLC22A16GSRCPT2CPT1AMAPT
Carnitine SCHEMBL27492466 0.85 SLC22A16 (0.59) SLC22A16GSRCPT2CPT1AMAPT
Levocarnitine SCHEMBL6635924 0.85 SLC22A16 (0.59) SLC22A16GSRCPT2CPT1AMAPT
Levocarnitine SCHEMBL6636808 0.84 SLC22A16 (0.57) SLC22A16GSRCPT2CPT1AMAPT
Carnitine SCHEMBL27798506 0.84 SLC22A16 (0.61) SLC22A16GSRCPT2CPT1AMAPT
Carnitine SCHEMBL27474612 0.83 SLC22A16 (0.65) SLC22A16CPT2CPT1AMAPTMEN1
Levocarnitine SCHEMBL2447788 0.83 GSR (0.56) SLC22A16GSRMAPTARG2NOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1196672-C Non-hydroscopic salts of active ingredients having therapeutical and/or nutritional activities and orally administrable compositions containing same BIOSALTS SRL (IT) 2005-04-13 — — CN claimed
CN-1372540-A Non-hydroscopic salts of active ingredients having therapeutical and/or nutritional activities and orally administrable compositions containing same BIOSALTS SRL (IT) 2002-10-02 — — CN claimed
CN-1196672-C Non-hydroscopic salts of active ingredients having therapeutical and/or nutritional activities and orally administrable compositions containing same BIOSALTS SRL (IT) 2005-04-13 — — CN disclosed
CN-1372540-A Non-hydroscopic salts of active ingredients having therapeutical and/or nutritional activities and orally administrable compositions containing same BIOSALTS SRL (IT) 2002-10-02 — — CN disclosed
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