Hydrochloric Acid

Hydrochloric Acid

SCHEMBL1933284

CCCCCCCCCCCCCCCCn1ccccc1=O.Cl

nearest known ligand 0.46

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
HSP90AA1 known ✓ P07900 1/20 0.45
CA2 known ✓ P00918 1/20 0.44
JAK2 known ✓ O60674 1/20 0.43
EGFR known ✓ P00533 1/20 0.43
FLT3 known ✓ P36888 1/20 0.43
ITK known ✓ Q08881 1/20 0.43
PTGS1 known ✓ P23219 3/20 0.43
PTGS2 known ✓ P35354 3/20 0.43
ALDH1A1 P00352 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46
TP53 P04637 2/20 0.45
CYP3A4 P08684 1/20 0.45
G6PD P11413 1/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45
HIF1A Q16665 1/20 0.45
HSD17B10 Q99714 1/20 0.45

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
SCHEMBL10764271 0.98 ALDH1A1 (0.47) ALDH1A1CYP1A2CYP2D6CYP2C19TP53
SCHEMBL11613395 0.98 ALDH1A1 (0.47) ALDH1A1CYP1A2CYP2D6CYP2C19TP53
SCHEMBL8778695 0.98 ALDH1A1 (0.47) ALDH1A1CYP1A2CYP2D6CYP2C19TP53
SCHEMBL12096492 0.98 ALDH1A1 (0.47) ALDH1A1CYP1A2CYP2D6CYP2C19TP53
SCHEMBL10767578 0.98 ALDH1A1 (0.47) ALDH1A1CYP1A2CYP2D6CYP2C19TP53
SCHEMBL2495415 0.96 TP53 (0.45) ALDH1A1CYP1A2CYP2D6CYP2C19TP53
SCHEMBL6727933 0.91 L3MBTL1 (0.47) ALDH1A1TP53HPGDNPC1MITF
SCHEMBL9752728 0.89 L3MBTL1 (0.50) TP53TSHRNPC1MITFLMNA
SCHEMBL9752719 0.89 L3MBTL1 (0.50) TP53TSHRNPC1MITFLMNA
SCHEMBL9752571 0.89 L3MBTL1 (0.50) TP53TSHRNPC1MITFLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2503982-B1 CONCENTRATES FOR TREATING SUBSTRATES COGNIS IP MAN GMBH (DE) 2018-04-25 EP disclosed
WO-2014202150-A1 NEW CATIONIC DYES, KITS AND COMPOSITIONS THEREOF, AND PROCESS FOR DYEING KERATIN FIBERS ALFA PARF GROUP S.P.A. (IT) 2014-12-24 WO disclosed
EP-1982749-B1 Novel hair colouring compositions for use in oxidative hair dyeing PROCTER & GAMBLE (US) 2013-04-17 EP disclosed
EP-2503982-A2 CONCENTRATES FOR TREATING SUBSTRATES Cognis IP Management GmbH (DE) 2012-10-03 EP disclosed
WO-2011063902-A2 CONCENTRATES FOR TREATING SUBSTRATES COGNIS IP MANAGEMENT GMBH (DE) 2011-06-03 WO disclosed
EP-2327390-A1 Concentrates for treating substrates Cognis IP Management GmbH (DE) 2011-06-01 EP disclosed
EP-1359890-A4 PRIMARY INTERMEDIATES FOR OXIDATIVE COLORATION OF HAIR P & G CLAIROL INC (US) 2009-08-12 EP disclosed
EP-1353638-A4 NOVEL COUPLERS FOR USE IN OXIDATIVE HAIR DYEING P & G CLAIROL INC (US) 2008-12-03 EP disclosed
EP-1353637-A4 NOVEL COUPLERS FOR USE IN OXIDATIVE HAIR DYEING P & G CLAIROL INC (US) 2008-12-03 EP disclosed
EP-1982749-A2 Novel hair colouring compositions for use in oxidative hair dyeing The Procter and Gamble Company (US) 2008-10-22 EP disclosed
US-20020102224-A1 Novel coupler for use in oxidative hair dyeing WELLA OPERATIONS US, LLC 2002-08-01 US disclosed
WO-2002058632-A2 PRIMARY INTERMEDIATES FOR OXIDATIVE COLORATION OF HAIR P&G-CLARIOL, INC. (US) 2002-08-01 WO disclosed
WO-2002047635-A1 NOVEL COUPLER FOR USE IN OXIDATIVE HAIR DYEING P&G-CLAIROL, INC. (US) 2002-06-20 WO disclosed
WO-2002045675-A1 PRIMARY INTERMEDIATES FOR OXIDATIVE COLORATION OF HAIR P&G - CLAIROL, INC. (US) 2002-06-13 WO disclosed
WO-2002039969-A1 NOVEL COUPLER FOR USE IN OXIDATIVE HAIR DYEING P&G-CLAIROL, INC. (US) 2002-05-23 WO disclosed
WO-2002039967-A1 NOVEL COUPLER FOR USE IN OXIDATIVE HAIR DYEING P&G - CLAIROL, INC. (US) 2002-05-23 WO disclosed
WO-2002039970-A1 NOVEL COUPLER FOR USE IN OXIDATIVE HAIR DYEING P&G - CLAIROL, INC. (US) 2002-05-23 WO disclosed
WO-2002039968-A1 NOVEL COUPLER FOR USE IN OXIDATIVE HAIR DYEING P&G - CLAIROL, INC. (US) 2002-05-23 WO disclosed
US-5827503-A ORAL APPLICATION OF ALKYLDIMETHYBENZYLAMMONIUM CHLORIDE, SODIUM CHLORIDE AND WATER BY RINSING OR MOUTHWASH OR TOOTH PASTE TO PREVENT PERIODONTITIS, GINGIVITIS, HALITOSIS, APHTHOUS ULCER OR PLAQUE FORMATION COLLAGENEX PHARMACEUTICALS, INC. (US) 1998-10-27 US disclosed
WO-1998005297-A1 COMPOSITION FOR TREATING PERIODONTITIS COLLAGENEX PHARM INC (US) 1998-02-12 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 (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-20020102224-A1 Novel coupler for use in oxidative hair dyeing CBR1, CBR3, PYCR1 HSP90AA1 3923/4885CA2 1540/4885JAK2 4840/4885

“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.