Hydrochloric Acid

Hydrochloric Acid

SCHEMBL974818

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

nearest known ligand 0.40

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 17)

geneUniProtsupporting neighboursconfidence
ITGB3 known ✓ P05106 1/20 0.37
ITGA2B known ✓ P08514 1/20 0.37
CACNA1B known ✓ Q00975 2/20 0.36
GAA known ✓ P10253 1/20 0.35
FOLH1 Q04609 1/20 0.37
C3AR1 Q16581 1/20 0.36
ALOX15 P16050 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
CYP1A2 P05177 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPY4R P50391 8/20 0.35
NPY1R P25929 5/20 0.35
NPY2R P49146 3/20 0.35
NPY5R Q15761 3/20 0.35
NOD1 Q9Y239 2/20 0.35
OTC P00480 1/20 0.33

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 SCHEMBL7367067 1.00 FOLH1 (0.37) FOLH1ITGB3ITGA2BCACNA1BC3AR1
Hydrochloric Acid SCHEMBL1578565 1.00 FOLH1 (0.37) FOLH1ITGB3ITGA2BCACNA1BC3AR1
SCHEMBL17769024 0.98 FOLH1 (0.38) FOLH1ITGB3ITGA2BCACNA1BC3AR1
SCHEMBL93472 0.98 FOLH1 (0.38) FOLH1ITGB3ITGA2BCACNA1BC3AR1
SCHEMBL93473 0.98 FOLH1 (0.38) FOLH1ITGB3ITGA2BCACNA1BC3AR1
SCHEMBL162756 0.98 FOLH1 (0.38) FOLH1ITGB3ITGA2BCACNA1BC3AR1
Acetic Acid SCHEMBL160844 0.95 FOLH1 (0.39) FOLH1ITGB3ITGA2BCACNA1BC3AR1
Acetic Acid SCHEMBL2170653 0.95 FOLH1 (0.39) FOLH1ITGB3ITGA2BCACNA1BC3AR1
Acetic Acid SCHEMBL1551710 0.95 FOLH1 (0.39) FOLH1ITGB3ITGA2BCACNA1BC3AR1
SCHEMBL8663352 0.93 FOLH1 (0.43) FOLH1ALOX15MEN1KMT2ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882014-A1 PROCESS FOR THE PREPARATION OF N?G -MONOMETHYL-L-ARGININE HYDROCHLORIDE GLAXO GROUP LIMITED (GB) 1998-12-09 EP claimed
WO-1997030972-A1 PROCESS FOR THE PREPARATION OF NG-MONOMETHYL-L-ARGININE HYDROCHLORIDE GLAXO GROUP LIMITED (GB) 1997-08-28 WO claimed
EP-0651741-B1 NG-MONOMETHYL-L-ARGININE HYDROCHLORIDE DERIVATIVES AND PROCESS FOR THEIR PREPARATION WELLCOME FOUND (GB) 1997-01-29 EP claimed
EP-0651741-A1 N?G -MONOMETHYL-L-ARGININE HYDROCHLORIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF SEPTIC SHOCK. WELLCOME FOUND (GB) 1995-05-10 EP claimed
CN-1087624-A Arginine derivative WELLCOME FOUND (GB) 1994-06-08 CN claimed
WO-1994002453-A1 NG-MONOMETHYL-L-ARGININE HYDROCHLORIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF SEPTIC SHOCK THE WELLCOME FOUNDATION LIMITED (GB) 1994-02-03 WO claimed
CN-117740961-A Compound analysis method of liquorice and liquorice probiotics fermentation preparation 北京中医药大学 2024-03-22 CN disclosed
US-10385009-B2 Deuterated compounds and uses thereof BIOSTATUS LIMITED (GB) 2019-08-20 US disclosed
EP-2564871-B1 Therapeutic Agent for Migraine KYOWA HAKKO KIRIN CO LTD (JP) 2017-11-15 EP disclosed
US-9254283-B2 Therapeutic agent for migraine KYOWA HAKKO KIRIN CO., LTD. (JP) 2016-02-09 US disclosed
US-20150307441-A1 NEW COMPOUNDS AND USES THEREOF BIOSTATUS LIMITED (GB) 2015-10-29 US disclosed
CN-104837814-A Novel compound and use thereof BIOSTATUS LTD 2015-08-12 CN disclosed
EP-2882708-A1 NEW COMPOUNDS AND USES THEREOF Biostatus Limited (GB) 2015-06-17 EP disclosed
EP-0696274-A1 PROCESS FOR PREPARING NG-MONOALKYL-L-ARGININE AND RELATED COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1996-02-14 EP disclosed
EP-0651741-A1 N?G -MONOMETHYL-L-ARGININE HYDROCHLORIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF SEPTIC SHOCK. WELLCOME FOUND (GB) 1995-05-10 EP disclosed
WO-1994026701-A1 PROCESS FOR PREPARING NG-MONOALKYL-L-ARGININE AND RELATED COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1994-11-24 WO disclosed
EP-0610432-A1 C8-CYCLIC PEPTIDOMIMETICS AS FIBRINOGEN ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1994-08-17 EP disclosed
CN-1087624-A Arginine derivative WELLCOME FOUND (GB) 1994-06-08 CN disclosed
WO-1994002453-A1 NG-MONOMETHYL-L-ARGININE HYDROCHLORIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF SEPTIC SHOCK THE WELLCOME FOUNDATION LIMITED (GB) 1994-02-03 WO disclosed
WO-1993009133-A1 C8-CYCLIC PEPTIDOMIMETICS AS FIBRINOGEN ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1993-05-13 WO 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-10385009-B2 Deuterated compounds and uses thereof HIF1AN, HIF1A, EGLN2 ITGB3 3454/4885ITGA2B 2768/4885CACNA1B 4729/4885
US-20150307441-A1 NEW COMPOUNDS AND USES THEREOF HIF1AN, HIF1A, EGLN2 ITGB3 3091/4885ITGA2B 1592/4885CACNA1B 4633/4885

“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.