Valine

Valine

SCHEMBL132740

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

nearest known ligand 0.00

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 Valine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
Valine SCHEMBL16893970 1.00 SLC7A5 (0.94)
Valine SCHEMBL14637050 1.00
Valine SCHEMBL16893971 1.00 SLC7A5 (0.94)
Valine SCHEMBL3426769 1.00 SLC7A5 (0.94)
Valine SCHEMBL245432 1.00
Valine SCHEMBL23777447 1.00 SLC7A5 (0.94)
Valine SCHEMBL3402665 1.00 SLC7A5 (0.94)
Valine SCHEMBL10775583 1.00 SLC7A5 (0.94)
Valine SCHEMBL9439900 1.00 SLC7A5 (0.94)
Valine SCHEMBL351273 0.97 SLC7A5 (0.88)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118993916-A Purification method of L-valine 东晓生物科技股份有限公司 2024-11-22 CN claimed
CN-118258947-A Method for measuring nitrogen component content in soil 东北农业大学 2024-06-28 CN claimed
CN-117761239-A Method for measuring content of elemental iron in iron-containing material 湖北楚凯冶金有限公司 2024-03-26 CN claimed
CN-113161447-B Phosphine annealing pretreatment method for casting monocrystalline or polycrystalline silicon slice 福建新峰二维材料科技有限公司 2023-11-28 CN claimed
CN-116858989-A Residual alkali testing method for layered oxide cathode material of sodium ion battery 蜂巢能源科技股份有限公司 2023-10-10 CN claimed
WO-2023170279-A1 ORALLY ACTIVE PRODRUG OF GEMCITABINE LAEVOROC CHEMOTHERAPY AG (CH) 2023-09-14 WO claimed
US-11708368-B2 Crystal form of ethyl (S)-3-(8-bromo-1-methyl-6-(pyridin-2-yl)-4H-benzo[f]imidazo[1,2-a][1,4]diazepin-4-yl)propanoate hydrochloride JIANGSU NHWALUOKANG PHARMACEUTICAL RESEARCH AND DEVELOPMENT CO., LTD. (CN) 2023-07-25 US claimed
CN-112176011-B Method for preparing valaciclovir hydrochloride through enzyme catalysis 辰欣药业股份有限公司 2022-10-18 CN claimed
CN-115011551-A Improved whole-course embryo culture solution and preparation method thereof 成都艾伟孚生物科技有限公司 2022-09-06 CN claimed
CN-112436063-B Preparation method of cast monocrystalline silicon heterojunction solar cell 福建新峰二维材料科技有限公司 2022-07-15 CN claimed
WO-2001058928-A1 N-TERMINAL D(-)-PENICILLAMINE PEPTIDES AS ALDEHYDE SEQUESTRATION AGENTS NAGASAWA HERBERT T (US) 2001-08-16 WO claimed
EP-0877746-A1 PROCESS FOR PREPARING PURINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1998-11-18 EP claimed
WO-1997027195-A1 PROCESS FOR PREPARING PURINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1997-07-31 WO claimed
US-5480574-A 2-aminocarboxylic acid hydrochloride compositions for removal of hard-water deposits SINGERMAN GARY M (US) 1996-01-02 US claimed
EP-0468929-B1 Stabilized pharmaceutical compositions SANDOZ LTD (CH) 1994-09-28 EP claimed
EP-0468929-A2 Stabilized pharmaceutical compositions SANDOZ LTD. (CH) 1992-01-29 EP claimed
US-4505909-A Method and composition for treating and preventing irritation of the eyes BERNSTEIN JOEL E (US) 1985-03-19 US claimed
EP-0035799-B1 PROCESS FOR OBTAINING PHENYL ALANINE SOCIETE DES PRODUITS NESTLE S.A. (CH) 1984-07-11 EP claimed
EP-0048023-A2 Composition for treating and preventing irritation of the eyes Bernstein, Joel E., M.D. (US) 1982-03-24 EP claimed
EP-0035799-A2 Process for obtaining phenyl alanine SOCIETE DES PRODUITS NESTLE S.A. (CH) 1981-09-16 EP claimed