Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4977968

Cl.NC(Cc1ccccc1)C(O)CCl

nearest known ligand 0.54

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 0.46
SLC6A2 known ✓ P23975 2/20 0.45
MAOA known ✓ P21397 1/20 0.45
SLC6A4 known ✓ P31645 1/20 0.45
SLC6A3 known ✓ Q01959 1/20 0.45
SIGMAR1 known ✓ Q99720 1/20 0.45
CSNK1E P49674 1/20 0.54
EPHX1 P07099 1/20 0.54
SLC15A1 P46059 1/20 0.47
ANPEP P15144 2/20 0.47
ALPI P09923 1/20 0.46
PKM P14618 1/20 0.46
XIAP P98170 1/20 0.46
SLC7A5 Q01650 1/20 0.46
TAAR1 Q96RJ0 2/20 0.45
CYP2A6 P11509 1/20 0.45
ADORA2A P29274 1/20 0.45
ADORA1 P30542 1/20 0.45
LAP3 P28838 3/20 0.43
TRPA1 O75762 1/20 0.43

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
Hydrochloric Acid SCHEMBL2232703 1.00 CSNK1E (0.54) CSNK1EEPHX1SLC15A1ANPEPALPI
Hydrochloric Acid SCHEMBL5168479 1.00 CSNK1E (0.54) CSNK1EEPHX1SLC15A1ANPEPALPI
SCHEMBL6578241 0.98 EPHX1 (0.56) CSNK1EEPHX1SLC15A1ANPEPALPI
SCHEMBL14671509 0.98 EPHX1 (0.56) CSNK1EEPHX1SLC15A1ANPEPALPI
SCHEMBL996512 0.98 EPHX1 (0.56) CSNK1EEPHX1SLC15A1ANPEPALPI
SCHEMBL5170196 0.98 EPHX1 (0.56) CSNK1EEPHX1SLC15A1ANPEPALPI
SCHEMBL14541149 0.98 EPHX1 (0.56) CSNK1EEPHX1SLC15A1ANPEPALPI
SCHEMBL7983260 0.98 EPHX1 (0.56) CSNK1EEPHX1SLC15A1ANPEPALPI
SCHEMBL14541480 0.98 EPHX1 (0.56) CSNK1EEPHX1SLC15A1ANPEPALPI
Formic Acid SCHEMBL3032993 0.90 SLC15A1 (0.50) CSNK1EEPHX1SLC15A1ANPEPALPI

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
EP-1148046-B1 PROCESS FOR THE PREPARATION OF ALPHA-AMINOKETONES AJINOMOTO KK (JP) 2008-10-22 EP disclosed
US-6683214-B2 REACTING A N-PROTECTED AMINOACID ESTER WITH HALOMETHYLLITHIUM COMPOUND; THEN ACID AJINOMOTO CO., INC. (JP) 2004-01-27 US disclosed
US-20030065222-A1 Process for producing alpha-aminoketones AJINOMOTO CO., INC. (JP) 2003-04-03 US disclosed
US-6500985-B2 FROM A N-PROTECTED-A-AMINO ESTER AJINOMOTO CO., INC. (JP) 2002-12-31 US disclosed
US-20020013499-A1 Process for producing alpha-aminoketones AJINOMOTO CO., INC. (JP) 2002-01-31 US disclosed
EP-1148046-A1 PROCESS FOR THE PREPARATION OF ALPHA-AMINOKETONES Ajinomoto Co., Inc. (JP) 2001-10-24 EP 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-20030065222-A1 Process for producing alpha-aminoketones AADAT, BCAT2, BCKDK PTGS1 3535/4885SLC6A2 3024/4885MAOA 2152/4885
US-20020013499-A1 Process for producing alpha-aminoketones AADAT, BCAT2, BCKDK PTGS1 3535/4885SLC6A2 3024/4885MAOA 2152/4885

“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.