Hydrochloric Acid

Hydrochloric Acid

SCHEMBL346303

C=C(C)C(=O)ONCCCCCCCCCC.Cl

nearest known ligand 0.53

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
HSP90AA1 known ✓ P07900 1/20 0.37
TSHR P16473 2/20 0.53
EPHX1 P07099 7/20 0.43
FAAH O00519 1/20 0.41
ZDHHC20 Q5W0Z9 1/20 0.41
ZDHHC2 Q9UIJ5 1/20 0.41
CASP2 P42575 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CNR2 P34972 1/20 0.39
NAAA Q02083 1/20 0.37
SPHK1 Q9NYA1 2/20 0.36

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
SCHEMBL27643100 0.98 TSHR (0.55) TSHREPHX1FAAHZDHHC20ZDHHC2
SCHEMBL16176196 0.98 TSHR (0.55) TSHREPHX1FAAHZDHHC20ZDHHC2
SCHEMBL27489106 0.98 TSHR (0.55) TSHREPHX1FAAHZDHHC20ZDHHC2
SCHEMBL18725606 0.98 TSHR (0.55) TSHREPHX1FAAHZDHHC20ZDHHC2
SCHEMBL20427935 0.98 TSHR (0.55) TSHREPHX1FAAHZDHHC20ZDHHC2
SCHEMBL8154331 0.96 TSHR (0.52) TSHREPHX1FAAHZDHHC20ZDHHC2
SCHEMBL4609619 0.91 TSHR (0.48) TSHREPHX1ALDH1A1CNR2
SCHEMBL28507521 0.89 TSHR (0.47) TSHREPHX1ALDH1A1CNR2
Hydrochloric Acid SCHEMBL4449709 0.85 ALDH1A1 (0.44) TSHRALDH1A1
SCHEMBL28013640 0.85 EPHX1 (0.52) EPHX1FAAHZDHHC20ZDHHC2CASP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106176250-B Tooth adhesive system based on new hydrophobic adhesion concept 浙江大学 2020-06-23 CN claimed
CN-106137774-B Pit and fissure sealant based on tooth surface hydrophobization concept 浙江大学 2020-04-17 CN claimed
US-20240164993-A1 ORGANOSILICON COMPOUND AND DENTAL COMPOSITION CONTAINING SAME KURARAY NORITAKE DENTAL INC. (JP) 2024-05-23 US disclosed
EP-4364718-A1 DENTAL CURABLE COMPOSITION Kuraray Noritake Dental Inc. (JP) 2024-05-08 EP disclosed
US-20240139078-A1 DENTAL FILLING KIT KURARAY NORITAKE DENTAL INC. (JP) 2024-05-02 US disclosed
EP-4360609-A1 DENTAL ADHESIVE KIT Kuraray Noritake Dental Inc. (JP) 2024-05-01 EP disclosed
US-20240091107-A1 DENTAL COMPOSITION KURARAY NORITAKE DENTAL INC. (JP) 2024-03-21 US disclosed
US-20240074945-A1 CURABLE COMPOSITION FOR DENTAL RESTORATION KURARAY NORITAKE DENTAL INC. (JP) 2024-03-07 US disclosed
US-20240074946-A1 DENTAL COMPOSITION KURARAY NORITAKE DENTAL INC. (JP) 2024-03-07 US disclosed
EP-4324450-A1 DENTAL FILLING KIT Kuraray Noritake Dental Inc. (JP) 2024-02-21 EP disclosed
EP-3936109-B1 SOLVENT-FREE ADHESIVE COMPOSITION FOR DENTAL USE KURARAY NORITAKE DENTAL INC (JP) 2024-02-14 EP disclosed
EP-1695685-A1 ONE-PACK TYPE ADHESIVE COMPOSITION FOR DENTAL USE Kuraray Medical Inc. (JP) 2006-08-30 EP disclosed
EP-1057468-B1 Adhesive composition and method for producing it KURARAY CO (JP) 2006-07-19 EP disclosed
US-20060078510-A1 Dental coating kit KURARAY MEDICAL INC. (JP) 2006-04-13 US disclosed
EP-1550428-A1 DENTAL COATING KIT Kuraray Medical Inc. (JP) 2005-07-06 EP disclosed
US-6887920-B2 Fillings and composite dental materials containing the fillings KURARAY CO., LTD. (JP) 2005-05-03 US disclosed
US-20030060533-A1 A metal oxide and a water-soluble metal salt each forming an independent phase; high water resistance and high acid resistance, and high releasing abilities of ions such as fluorine ions KURARAY NORITAKE DENTAL INC. (JP) 2003-03-27 US disclosed
US-6512068-B1 Substantially transparent adhesive composition for hard tissue, and a method for producing it; the adhesive composition exhibits good adhesiveness to hard tissue, especially to both enamel and dentin, and has the advantage of KURARAY CO., LTD. (JP) 2003-01-28 US disclosed
EP-1270688-A1 FILLINGS AND COMPOSITE DENTAL MATERIALS CONTAINING THE FILLINGS KURARAY CO., LTD. (JP) 2003-01-02 EP disclosed
EP-1057468-A1 Adhesive composition and method for producing it KURARAY CO., LTD. (JP) 2000-12-06 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 (5 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-20240074946-A1 DENTAL COMPOSITION PIEZO1, TAS2R42, EIF2B3 HSP90AA1 103/4885TSHR 3861/4885EPHX1 3937/4885
US-20240139078-A1 DENTAL FILLING KIT DHX29, DHX35, DHX15 HSP90AA1 2188/4885TSHR 4803/4885EPHX1 60/4885
US-20240091107-A1 DENTAL COMPOSITION CCT7, TAS2R42, CCT5 HSP90AA1 105/4885TSHR 3718/4885EPHX1 3257/4885
US-20240074945-A1 CURABLE COMPOSITION FOR DENTAL RESTORATION SMCHD1, WDR26, KAT6A HSP90AA1 230/4885TSHR 3667/4885EPHX1 3003/4885
US-20240164993-A1 ORGANOSILICON COMPOUND AND DENTAL COMPOSITION CONTAINING SAME MSL1, ITGA1, ASH2L HSP90AA1 2023/4885TSHR 4172/4885EPHX1 861/4885

“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.