Leucine

Leucine

SCHEMBL4185791

CC(C)C[C@H](N)C(=O)O.Cc1cc(=O)oc2cc(N)ccc12.Cl

nearest known ligand 0.63

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 Leucine. 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
GLA known ✓ P06280 5/20 0.63
GAA known ✓ P10253 5/20 0.63
MAOB known ✓ P27338 1/20 0.46
KDR known ✓ P35968 1/20 0.46
ALDH1A1 P00352 9/20 0.63
KDM4E B2RXH2 8/20 0.63
HPGD P15428 6/20 0.63
HSD17B10 Q99714 4/20 0.63
CA12 O43570 4/20 0.63
CA9 Q16790 4/20 0.63
CA1 P00915 3/20 0.63
CASP1 P29466 2/20 0.63
CASP7 P55210 2/20 0.63
L3MBTL1 Q9Y468 2/20 0.51
MAPK1 P28482 1/20 0.51
HTT P42858 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
AR P10275 2/20 0.47
ALDH2 P05091 1/20 0.47
IGLV6-57 P01721 3/20 0.46

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
Leucine SCHEMBL22611961 1.00 ALDH1A1 (0.63) ALDH1A1KDM4EHPGDGLAGAA
Leucine SCHEMBL27779804 0.99 ALDH1A1 (0.64) ALDH1A1KDM4EHPGDGLAGAA
Leucine SCHEMBL19695473 0.99 ALDH1A1 (0.64) ALDH1A1KDM4EHPGDGLAGAA
Leucine SCHEMBL1776947 0.99 ALDH1A1 (0.64) ALDH1A1KDM4EHPGDGLAGAA
Serine SCHEMBL4186225 0.88 ALDH1A1 (0.66) ALDH1A1KDM4EHPGDGLAGAA
Aspartic Acid SCHEMBL7700638 0.88 ALDH1A1 (0.66) ALDH1A1KDM4EHPGDGLAGAA
Aspartic Acid SCHEMBL7700642 0.88 ALDH1A1 (0.66) ALDH1A1KDM4EHPGDGLAGAA
Asparagine SCHEMBL27896279 0.87 ALDH1A1 (0.64) ALDH1A1KDM4EHPGDGLAGAA
Asparagine SCHEMBL4176738 0.87 ALDH1A1 (0.64) ALDH1A1KDM4EHPGDGLAGAA
Serine SCHEMBL6428011 0.87 ALDH1A1 (0.68) ALDH1A1KDM4EHPGDGLAGAA

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 70 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240084308-A1 FIBROTIC TREATMENT MONASH UNIVERSITY (AU) 2024-03-14 US claimed
US-11834663-B2 Fibrotic treatment MONASH UNIVERSITY (AU) 2023-12-05 US claimed
US-20210340547-A1 FIBROTIC TREATMENT MONASH UNIVERSITY (AU) 2021-11-04 US claimed
US-11078488-B2 Fibrotic treatment MONASH UNIVERSITY (AU) 2021-08-03 US claimed
US-20200362354-A1 FIBROTIC TREATMENT MONASH UNIVERSITY (AU) 2020-11-19 US claimed
US-10787668-B2 Fibrotic treatment MONASH UNIVERSITY (AU) 2020-09-29 US claimed
EP-3328384-B1 FIBROTIC TREATMENT UNIV MONASH (AU) 2020-07-29 EP claimed
US-10100311-B2 Fibrotic treatment MONASH UNIVERSITY (AU) 2018-10-16 US claimed
US-20180223287-A1 FIBROTIC TREATMENT MONASH UNIVERSITY (AU) 2018-08-09 US claimed
EP-3328384-A1 FIBROTIC TREATMENT Monash University (AU) 2018-06-06 EP claimed
WO-2017015720-A1 FIBROTIC TREATMENT MONASH UNIVERSITY (AU) 2017-02-02 WO claimed
EP-1352083-B1 COMPOSITIONS AND METHODS FOR DETECTING TARGET MICROORGANISMS IN A SAMPLE BIOCONTROL SYSTEMS INC (US) 2005-10-26 EP claimed
EP-0946746-B1 METHOD AND MEDIA FOR THE DETECTION OF YEASTS AND/OR MOLDS IN A SAMPLE BIOCONTROL SYSTEMS INC (US) 2005-03-02 EP claimed
EP-1352083-A2 COMPOSITIONS AND METHODS FOR DETECTING TARGET MICROORGANISMS IN A SAMPLE BioControl Systems, Inc. (US) 2003-10-15 EP claimed
US-20020058298-A1 Compositions and methods for detecting target microorganisms in a sample BIOCONTROL SYSTEM, INC. (US) 2002-05-16 US claimed
WO-2002018625-A2 COMPOSITIONS AND METHODS FOR DETECTING TARGET MICROORGANISMS IN A SAMPLE BIOCONTROL SYSTEMS, INC. (US) 2002-03-07 WO claimed
US-6022698-A Method and components for the detection of yeasts and/or molds in a sample IDEXX LABORATORIES, INCORPORATED (US) 2000-02-08 US claimed
EP-0946746-A1 METHOD AND COMPONENTS FOR THE DETECTION OF YEASTS AND/OR MOLDS IN A SAMPLE IDEXX LABORATORIES, INC. (US) 1999-10-06 EP claimed
US-5854011-A Method and components for the detection of yeasts and/or molds in a sample IDEXX LABORATORIES INCORPORATED (US) 1998-12-29 US claimed
WO-1998027223-A1 METHOD AND COMPONENTS FOR THE DETECTION OF YEASTS AND/OR MOLDS IN A SAMPLE IDEXX LABORATORIES, INCORPORATED (US) 1998-06-25 WO claimed

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

For each of this compound's patents that has machine-readable text (8 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-10100311-B2 Fibrotic treatment ENPEP, IL4I1, LNPEP GLA 1078/4885GAA 1458/4885MAOB 1975/4885
US-10787668-B2 Fibrotic treatment ENPEP, IL4I1, LNPEP GLA 1078/4885GAA 1458/4885MAOB 1975/4885
US-20210340547-A1 FIBROTIC TREATMENT MMP1, ENPEP, RNPEP GLA 347/4885GAA 320/4885MAOB 2586/4885
US-20200362354-A1 FIBROTIC TREATMENT MMP1, ENPEP, RNPEP GLA 347/4885GAA 320/4885MAOB 2586/4885
US-20180223287-A1 FIBROTIC TREATMENT ENPEP, IL4I1, LNPEP GLA 1078/4885GAA 1458/4885MAOB 1975/4885
US-11834663-B2 Fibrotic treatment MMP1, ENPEP, RNPEP GLA 347/4885GAA 320/4885MAOB 2586/4885
US-11078488-B2 Fibrotic treatment MMP1, ENPEP, RNPEP GLA 347/4885GAA 320/4885MAOB 2586/4885
US-20240084308-A1 FIBROTIC TREATMENT MMP1, ENPEP, RNPEP GLA 347/4885GAA 320/4885MAOB 2586/4885

“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.