Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3423529

CCCCCCCCC(N)(CCCCCCCC)c1ccccc1C.Cl

nearest known ligand 0.41

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
S1PR1 known ✓ P21453 2/20 0.37
S1PR4 known ✓ O95977 1/20 0.35
S1PR3 known ✓ Q99500 1/20 0.35
S1PR5 known ✓ Q9H228 1/20 0.35
HSP90AA1 known ✓ P07900 1/20 0.35
KCNH2 known ✓ Q12809 1/20 0.33
CNR2 P34972 4/20 0.40
CNR1 P21554 3/20 0.40
TNNC1 P63316 5/20 0.35
HTT P42858 2/20 0.35
SGPL1 O95470 1/20 0.35
GPR183 P32249 1/20 0.35
CERS2 Q96G23 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
RGS12 O14924 1/20 0.35
NPC1 O15118 1/20 0.35
USP2 O75604 1/20 0.35
LMNA P02545 1/20 0.35
THRB P10828 1/20 0.35

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 SCHEMBL3025139 1.00 CNR2 (0.40) CNR2CNR1S1PR1TNNC1HTT
Hydrochloric Acid SCHEMBL3029594 1.00 CNR2 (0.40) CNR2CNR1S1PR1TNNC1HTT
Hydrochloric Acid SCHEMBL3023388 0.93 ESR1 (0.36) CNR2CNR1S1PR1TLR8
Hydrochloric Acid SCHEMBL5572019 0.87 CNR1 (0.43) CNR2CNR1S1PR1TNNC1HTT
Hydrochloric Acid SCHEMBL9346395 0.85 CNR2 (0.43) CNR2CNR1S1PR1TNNC1SGPL1
Hydrochloric Acid SCHEMBL456432 0.85 CNR2 (0.43) CNR2CNR1S1PR1TNNC1SGPL1
Hydrochloric Acid SCHEMBL11053875 0.85 CNR2 (0.43) CNR2CNR1S1PR1TNNC1SGPL1
Hydrochloric Acid SCHEMBL1485770 0.85 CNR2 (0.43) CNR2CNR1S1PR1TNNC1SGPL1
Hydrochloric Acid SCHEMBL8172128 0.85 CNR2 (0.43) CNR2CNR1S1PR1TNNC1SGPL1
Hydrochloric Acid SCHEMBL10760883 0.83 CNR2 (0.40) CNR2CNR1S1PR1TNNC1SGPL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9631045-B2 Polycarbodiimides having onium salt groups PPG INDUSTRIES OHIO, INC. (US) 2017-04-25 US disclosed
WO-2014099923-A1 IMPROVED ANTIMICROBIAL EFFECTS IN POLYMERS BASF SE (DE) 2014-06-26 WO disclosed
US-20140170238-A1 Antimicrobial effects in polymers BASF SE (DE) 2014-06-19 US disclosed
US-8258202-B2 Antimicrobial coating compositions, related coatings and coated substrates PPG INDUSTRIES OHIO, INC (US) 2012-09-04 US disclosed
WO-2010093536-A1 POLYCARBODIIMIDES HAVING ONIUM SALT GROUPS PPG INDUSTRIES OHIO, INC. (US) 2010-08-19 WO disclosed
US-20100204515-A1 POLYCARBODIIMIDES HAVING ONIUM SALT GROUPS PPG INDUSTRIES OHIO, INC. (US) 2010-08-12 US disclosed
US-20100204357-A1 ANTIMICROBIAL COATING COMPOSITIONS, RELATED COATINGS AND COATED SUBSTRATES PPG INDUSTRIES OHIO, INC. (US) 2010-08-12 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-20100204515-A1 POLYCARBODIIMIDES HAVING ONIUM SALT GROUPS CA7, HDAC6, HDAC10 S1PR1 3947/4885S1PR4 2987/4885S1PR3 2786/4885

“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.