Hydrochloric Acid

Hydrochloric Acid

SCHEMBL510380

CCCCNc1ccc(C(=O)OC(C)N(CC)CC)cc1.Cl

nearest known ligand 0.58

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
SCN5A known ✓ Q14524 2/20 0.56
MAOA known ✓ P21397 1/20 0.56
DRD4 known ✓ P21917 1/20 0.56
ACHE known ✓ P22303 1/20 0.56
HRH2 known ✓ P25021 1/20 0.56
HTR2A known ✓ P28223 1/20 0.56
HTR2C known ✓ P28335 1/20 0.56
HRH1 known ✓ P35367 1/20 0.56
DRD3 known ✓ P35462 1/20 0.56
SCN1A known ✓ P35498 1/20 0.56
HTR2B known ✓ P41595 1/20 0.56
SCN7A known ✓ Q01118 1/20 0.56
SLC6A3 known ✓ Q01959 1/20 0.56
KCNH2 known ✓ Q12809 1/20 0.56
SCN9A known ✓ Q15858 1/20 0.56
SCN2A known ✓ Q99250 1/20 0.56
SIGMAR1 known ✓ Q99720 1/20 0.56
SCN3A known ✓ Q9NY46 1/20 0.56
SCN8A known ✓ Q9UQD0 1/20 0.56
HRH3 known ✓ Q9Y5N1 1/20 0.56

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
SCHEMBL510069 1.00 LMNA (0.58) LMNARAB9AKDM4EGMNNBLM
SCHEMBL29020376 0.85 LMNA (0.59) LMNARAB9AKDM4EGMNNBLM
Butane SCHEMBL6810096 0.83 RAB9A (0.56) LMNARAB9AKDM4EGMNNBLM
SCHEMBL5925590 0.82 ALDH1A1 (0.44) LMNARAB9AKDM4EMAPK1TSHR
Butane SCHEMBL21438842 0.81 LMNA (0.55) LMNARAB9AKDM4EGMNNBLM
SCHEMBL1118828 0.81 ALDH1A1 (0.43) LMNARAB9AKDM4EBLMMAPK1
SCHEMBL5925519 0.80 HSD17B10 (0.55) LMNARAB9AKDM4EBLMCYP1A2
SCHEMBL14149520 0.78 SCN5A (0.68) LMNARAB9AKDM4EGMNNBLM
Hydrochloric Acid SCHEMBL11345886 0.77 LMNA (0.50) LMNARAB9AKDM4EGMNNBLM
SCHEMBL11341345 0.76 LMNA (0.50) LMNARAB9AKDM4EGMNNBLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120029167-A1 AUTO MAGNETIC METAL SALEN COMPLEX COMPOUND YOSHIHIRO ISHIKAWA (JP) 2012-02-02 US claimed
EP-2357166-A1 AUTO MAGNETIC METAL SALEN COMPLEX COMPOUND IHI Corporation (JP) 2011-08-17 EP claimed
CN-119095642-A Locally applicable system 考司美德制药株式会社 2024-12-06 CN disclosed
CN-112672738-A Pharmaceutical composition 小林制药株式会社 2021-04-16 CN disclosed
EP-3705155-A1 DENTAL LOCAL ANESTHETIC MICRONEEDLE ARRAY Cosmed Pharmaceutical Co., Ltd. (JP) 2020-09-09 EP disclosed
US-9505732-B2 Auto magnetic metal salen complex compound IHI CORPORATION (JP) 2016-11-29 US disclosed
US-9034843-B2 Ophthalmic composition ROHTO PHARMACEUTICAL CO., LTD. (JP) 2015-05-19 US disclosed
US-8754029-B2 Ophthalmic composition ROHTO PHARMACEUTICAL CO., LTD. (JP) 2014-06-17 US disclosed
US-20130244978-A1 OPHTHALMIC COMPOSITION ROHTO PHARMACEUTICAL CO., LTD. (JP) 2013-09-19 US disclosed
US-20130102977-A1 OPHTHALMIC COMPOSITION ROHTO PHARMACEUTICAL CO., LTD. (JP) 2013-04-25 US disclosed
CN-101854939-B Ophthalmic composition ROHTO PHARMA 2012-10-24 CN disclosed
US-20120029167-A1 AUTO MAGNETIC METAL SALEN COMPLEX COMPOUND YOSHIHIRO ISHIKAWA (JP) 2012-02-02 US disclosed
US-20110223126-A1 OPHTHALMIC COMPOSITION MATSUMURA YASUKO 2011-09-15 US disclosed
EP-2357166-A1 AUTO MAGNETIC METAL SALEN COMPLEX COMPOUND IHI Corporation (JP) 2011-08-17 EP disclosed
CN-101854939-A Ophthalmic composition ROHTO PHARMA 2010-10-06 CN disclosed
US-20100249062-A1 OPHTHALMIC COMPOSITION ROHTO PHARMACEUTICAL CO., LTD. (JP) 2010-09-30 US disclosed
US-20100239518-A1 OPHTHALMIC COMPOSITION ROHTO PHARMACEUTICAL CO., LTD. (JP) 2010-09-23 US disclosed
US-20100216741-A1 OPHTHALMIC COMPOSITION ROHTO PHARMACEUTICAL CO., LTD. (JP) 2010-08-26 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-20120029167-A1 AUTO MAGNETIC METAL SALEN COMPLEX COMPOUND SDHB, SDHA, SLC40A1 SCN5A 524/4885MAOA 73/4885DRD4 3807/4885

“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.