Hydrochloric Acid

Hydrochloric Acid

SCHEMBL1168634

C[C@H](N)c1ccccc1.Cl

nearest known ligand 0.94

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 11)

geneUniProtsupporting neighboursconfidence
DPP4 known ✓ P27487 2/20 0.55
ADRA2A known ✓ P08913 1/20 0.54
ADRA2C known ✓ P18825 1/20 0.54
ADRB2 known ✓ P07550 1/20 0.52
ALDH1A1 P00352 1/20 0.58
F2 P00734 1/20 0.55
LMNA P02545 1/20 0.54
HIF1A Q16665 1/20 0.54
KDM4E B2RXH2 1/20 0.54
TAAR1 Q96RJ0 4/20 0.50
AOC3 Q16853 1/20 0.44

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 SCHEMBL241514 1.00 ALDH1A1 (0.58) ALDH1A1DPP4F2ADRA2AADRA2C
Hydrochloric Acid SCHEMBL4381111 1.00 ALDH1A1 (0.58) ALDH1A1DPP4F2ADRA2AADRA2C
Hydrochloric Acid SCHEMBL4602345 1.00 ALDH1A1 (0.58) ALDH1A1DPP4F2ADRA2AADRA2C
Hydrochloric Acid SCHEMBL4381169 1.00 ALDH1A1 (0.58) ALDH1A1DPP4F2ADRA2AADRA2C
Hydrochloric Acid SCHEMBL27370227 0.97 ALDH1A1 (0.56) ALDH1A1DPP4F2ADRA2AADRA2C
SCHEMBL24932018 0.97 DPP4 (0.58) ALDH1A1DPP4F2ADRA2AADRA2C
SCHEMBL830 0.97
SCHEMBL5559781 0.97 DPP4 (0.58) ALDH1A1DPP4F2ADRA2AADRA2C
SCHEMBL4916236 0.97 DPP4 (0.58) ALDH1A1DPP4F2ADRA2AADRA2C
SCHEMBL5565016 0.97 DPP4 (0.58) ALDH1A1DPP4F2ADRA2AADRA2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0672030-B1 PROCESS FOR PREPARING SUBSTANTIALLY PURE ENANTIOMERS OF PHENYLPROPIONIC ACIDS KNOLL AG (DE) 1997-04-16 EP claimed
US-5599969-A PURIFICATION BY SALT FORMATION AND DESALTING THE BOOTS COMPANY PLC (GB) 1997-02-04 US claimed
EP-0714292-A4 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF CAMBRIDGE NEUROSCIENCE INC (US) 1996-10-09 EP claimed
EP-0714292-A1 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF CAMBRIDGE NEUROSCIENCE, INC. (US) 1996-06-05 EP claimed
WO-1995000131-A1 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF CAMBRIDGE NEUROSCIENCE, INCORPORATED (US) 1995-01-05 WO claimed
CN-110078736-B Pyrazolopyrimidine derivative, process for producing the same, and use thereof 广州白云山医药集团股份有限公司白云山制药总厂 2021-08-03 CN disclosed
CN-110078736-A Pyrazolopyrimidine derivative, preparation method and its application 广州白云山医药集团股份有限公司白云山制药总厂 2019-08-02 CN disclosed
US-9452974-B2 Stereoselective synthesis of metyrosine ATON PHARMA, INC. (US) 2016-09-27 US disclosed
CN-103804199-B Synthesis method of chiral alpha-phenylethylamine hydrochloride LUO MEI (CN) 2016-04-13 CN disclosed
US-20140350284-A1 STEREOSELECTIVE SYNTHESIS OF METYROSINE JPMORGAN CHASE BANK, N.A. 2014-11-27 US disclosed
US-8841486-B2 Stereoselective synthesis of metyrosine ATON PHARMA (US) 2014-09-23 US disclosed
CN-103804199-A Synthetic method of chiral alpha-phenylethylamine hydrochloride LUO MEI 2014-05-21 CN disclosed
US-5599969-A PURIFICATION BY SALT FORMATION AND DESALTING THE BOOTS COMPANY PLC (GB) 1997-02-04 US disclosed
EP-0672030-A1 PROCESS FOR PREPARING SUBSTANTIALLY PURE ENANTIOMERS OF PHENYLPROPIONIC ACIDS. BOOTS CO PLC (GB) 1995-09-20 EP disclosed
US-5349079-A Process for forming α-aminonitriles from carbonyl compound and fatty amine hydrohalide AKZO NOBEL NV (NL) 1994-09-20 US disclosed
US-5340802-A Central nervous system disorders ABBOTT LABORATORIES (US) 1994-08-23 US disclosed
WO-1994012460-A1 PROCESS FOR PREPARING SUBSTANTIALLY PURE ENANTIOMERS OF PHENYLPROPIONIC ACIDS THE BOOTS COMPANY PLC (GB) 1994-06-09 WO disclosed
US-5288747-A Method of controlling or preventing phytopathogenic microorganism infestation of plants using propiconazole as a seed dressing CIBA-GEIGY CORPORATION (US) 1994-02-22 US disclosed
WO-1991000724-A1 ALKYNYL AMINES THAT REGULATE CHOLINERGIC NEUROTRANSMISSION ABBOTT LABORATORIES (US) 1991-01-24 WO disclosed
US-4940799-A Preparation of the diastereomeric mixture 2R,4S-1-[2-(2,4-dichlorophenyl)-4-n-propyl-1,3-dioxolan-2-ylmethyl]-1H-1,2,4-triazole CIBA-GEIGY CORPORATION (US) 1990-07-10 US 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 (1 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-20140350284-A1 STEREOSELECTIVE SYNTHESIS OF METYROSINE PTMA, PTMS, METTL3 DPP4 469/4885ADRA2A 100/4885ADRA2C 46/4885

“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.