Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6697015

Cl.N[C@@H](Cc1cn(O)cn1)C(=O)O

nearest known ligand 0.45

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 Hydrochloric Acid. 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
PTGS1 known ✓ P23219 1/20 0.41
TYR P14679 5/20 0.45
CYP1A2 P05177 1/20 0.44
SLC1A3 P43003 1/20 0.44
GRIA1 P42261 2/20 0.42
GRIA2 P42262 2/20 0.42
GRIA3 P42263 2/20 0.42
GRIA4 P48058 2/20 0.42
SLC7A5 Q01650 3/20 0.41
PKM P14618 2/20 0.41
ALPI P09923 1/20 0.41
XIAP P98170 1/20 0.41
HSD17B10 Q99714 2/20 0.38
CYP3A4 P08684 2/20 0.38
CPB2 Q96IY4 3/20 0.38
USP2 O75604 2/20 0.38
RGS12 O14924 1/20 0.38
CYP2C9 P11712 1/20 0.38
ALOX15 P16050 1/20 0.38
NFKB1 P19838 1/20 0.38

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
SCHEMBL14798187 0.98 CYP1A2 (0.45) TYRCYP1A2SLC1A3GRIA1GRIA2
SCHEMBL60911 0.98 CYP1A2 (0.45) TYRCYP1A2SLC1A3GRIA1GRIA2
SCHEMBL29624354 0.89 CYP1A2 (0.43) TYRCYP1A2SLC1A3GRIA1GRIA2
SCHEMBL27974517 0.83 CYP1A2 (0.46) TYRCYP1A2SLC1A3GRIA1GRIA2
Hydrochloric Acid SCHEMBL3843450 0.82 TDP1 (0.49) TYRCYP1A2SLC1A3GRIA1GRIA2
Hydrochloric Acid SCHEMBL14831326 0.82 CYP1A2 (0.43) TYRCYP1A2SLC1A3GRIA1GRIA2
SCHEMBL4727798 0.81 CYP1A2 (0.45) TYRCYP1A2SLC1A3GRIA1GRIA2
SCHEMBL44187 0.81 CYP1A2 (0.45) TYRCYP1A2SLC1A3GRIA1GRIA2
SCHEMBL4726518 0.81 CYP1A2 (0.45) TYRCYP1A2SLC1A3GRIA1GRIA2
SCHEMBL1678922 0.80 CYP1A2 (0.44) TYRCYP1A2SLC1A3GRIA1GRIA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4026546-A1 PREVENTION OR REMEDIATION COMPOSITION FOR DEMENTIA OR DEPRESSION AJINOMOTO CO., INC. (JP) 2022-07-13 EP disclosed
US-11007164-B2 Prevention or remediation composition for dementia or depression AJINOMOTO CO., INC. (JP) 2021-05-18 US disclosed
US-20190247347-A1 PREVENTION OR REMEDIATION COMPOSITION FOR DEMENTIA OR DEPRESSION AJINOMOTO CO., INC. (JP) 2019-08-15 US disclosed
EP-3510999-A1 PREVENTION OR REMEDIATION COMPOSITION FOR DEMENTIA OR DEPRESSION Ajinomoto Co., Inc. (JP) 2019-07-17 EP disclosed
EP-2742938-B1 AMINO-ACID-CONTAINING COMPOSITION FOR ENHANCING RECOVERY FROM MUSCLE FATIGUE AJINOMOTO KK (JP) 2018-05-09 EP disclosed
EP-2742938-A1 AMINO-ACID-CONTAINING COMPOSITION FOR ENHANCING RECOVERY FROM MUSCLE FATIGUE Ajinomoto Co., Inc. (JP) 2014-06-18 EP disclosed
US-20040137019-A1 Cosmetic w/o/w emulsion preparation SHISEIDO COMPANY, LTD. (JP) 2004-07-15 US disclosed
EP-1369101-A1 COSMETIC W/O/W EMULSION PREPARATION SHISEIDO COMPANY LIMITED (JP) 2003-12-10 EP disclosed