Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4820909

Cl.NCCc1cc(N)ccc1O

nearest known ligand 0.59

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
ACHE known ✓ P22303 3/20 0.58
PRKCI known ✓ P41743 1/20 0.55
ADRA2A known ✓ P08913 2/20 0.50
DRD2 known ✓ P14416 2/20 0.50
DRD1 known ✓ P21728 2/20 0.50
DRD4 known ✓ P21917 2/20 0.50
SLC6A2 known ✓ P23975 2/20 0.50
DRD3 known ✓ P35462 2/20 0.50
SLC6A3 known ✓ Q01959 2/20 0.50
GAA known ✓ P10253 1/20 0.50
ADRB2 known ✓ P07550 1/20 0.47
HTR1A known ✓ P08908 1/20 0.47
PTGS1 known ✓ P23219 1/20 0.47
ADRA1D known ✓ P25100 1/20 0.47
ADRA1A known ✓ P35348 1/20 0.47
ADRA1B known ✓ P35368 1/20 0.47
CA2 known ✓ P00918 1/20 0.45
RECQL P46063 4/20 0.59
TDP1 Q9NUW8 4/20 0.59
KDM4E B2RXH2 3/20 0.59

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 SCHEMBL29355907 1.00 RECQL (0.59) RECQLTDP1KDM4EMAPTMAPK1
SCHEMBL6157970 0.98 RECQL (0.58) RECQLTDP1KDM4EMAPTMAPK1
SCHEMBL5190794 0.88 PRKCI (0.52) RECQLTDP1KDM4EMAPTMAPK1
SCHEMBL22117739 0.85 PRKCI (0.53) RECQLTDP1KDM4EMAPTMAPK1
Hydrochloric Acid SCHEMBL2480499 0.84 ACHE (0.60) RECQLTDP1KDM4EMAPTMAPK1
Hydrochloric Acid SCHEMBL1986970 0.84 ACHE (0.60) RECQLTDP1KDM4EMAPTMAPK1
SCHEMBL146272 0.83 PRKCI (0.55) RECQLTDP1KDM4EMAPTMAPK1
SCHEMBL34055 0.82 PRKCI (0.59) RECQLTDP1KDM4EMAPTMAPK1
Hydrochloric Acid SCHEMBL3337180 0.82 ACHE (0.62) RECQLTDP1KDM4EMAPTMAPK1
Hydrochloric Acid SCHEMBL22612460 0.82 ACHE (0.62) RECQLTDP1KDM4EMAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2760425-B1 FOAM OXIDATIVE HAIR COLORANT COMPOSITION WITH THE FREE-BASE OF 1, 4-DIAMINO-2-METHOXMETHYL BENZENE NOXELL CORP (US) 2019-07-31 EP disclosed
EP-1814631-B1 A HIGH AQUEOUS OXIDATION HAIRCOLOR SYSTEM COMBE INC (US) 2015-12-02 EP disclosed
US-8529637-B2 Foam oxidative hair colorant composition with the free-base of 1,4-diamino-2-methoxymethyl benzene THE PROCTER & GAMBLE COMPANY (US) 2013-09-10 US disclosed
US-20130081647-A1 Foam Oxidative Hair Colorant Composition with the Free-Base of 1,4-Diamino-2-Methoxymethyl Benzene THE PROCTER & GAMBLE COMPANY (US) 2013-04-04 US disclosed
US-7419510-B2 High aqueous oxidation haircolor system COMBE INCORPORATED (US) 2008-09-02 US disclosed
EP-1814631-A2 A HIGH AQUEOUS OXIDATION HAIRCOLOR SYSTEM COMBE INCORPORATED (US) 2007-08-08 EP disclosed
WO-2006023842-A2 A HIGH AQUEOUS OXIDATION HAIRCOLOR SYSTEM COMBE INCORPORATED (US) 2006-03-02 WO disclosed
US-20060037153-A1 High aqueous oxidation haircolor system COMBE INCORPORTED 2006-02-23 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-20130081647-A1 Foam Oxidative Hair Colorant Composition with the Free-Base of 1,4-Diamino-2-Methoxymethyl Benzene DHODH, AOC1, GPX4 ACHE 3327/4885PRKCI 4663/4885ADRA2A 1186/4885

“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.