Hydrochloric Acid

Hydrochloric Acid

SCHEMBL16346103

COC(=O)c1ccccc1SCCc1ccccn1.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 17)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.53
POLB P06746 2/20 0.53
ALDH1A1 P00352 3/20 0.50
KDM4E B2RXH2 3/20 0.50
ALOX15 P16050 2/20 0.50
KMT2A Q03164 2/20 0.49
LMNA P02545 1/20 0.49
MAPK10 P53779 1/20 0.49
MEN1 O00255 1/20 0.48
TSHR P16473 1/20 0.48
PKM P14618 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
HTT P42858 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
MAPK1 P28482 1/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL16375089 0.99 HSD17B10 (0.55) HSD17B10POLBALDH1A1KDM4EALOX15
SCHEMBL20544306 0.82 RAB9A (0.54) POLBALDH1A1HTTNPC1RAB9A
Hydrochloric Acid SCHEMBL16346199 0.80 ALDH1A1 (0.56) POLBALDH1A1KDM4EKMT2AMEN1
SCHEMBL16375088 0.78 ALDH1A1 (0.58) POLBALDH1A1KDM4EKMT2AMEN1
SCHEMBL10144072 0.76 HSD17B10 (0.67) HSD17B10POLBALDH1A1KDM4EALOX15
SCHEMBL2797516 0.75 HSD17B10 (0.65) HSD17B10POLBALDH1A1KDM4EALOX15
SCHEMBL30149651 0.75 HSD17B10 (0.65) HSD17B10POLBALDH1A1KDM4EALOX15
SCHEMBL21505100 0.75 HSD17B10 (0.65) HSD17B10POLBALDH1A1KDM4EALOX15
Hydrochloric Acid SCHEMBL16346820 0.75 ALDH1A1 (0.52) ALDH1A1KDM4EALOX15KMT2ALMNA
SCHEMBL13869741 0.75 POLB (0.57) HSD17B10POLBALDH1A1KDM4EKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10178875-B2 Methods of modifying or imparting taste using organic compounds GIVAUDAN S.A. (CH) 2019-01-15 US claimed
EP-3019034-B1 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2018-10-31 EP claimed
US-20160366922-A1 ORGANIC COMPOUNDS GIVAUDAN S.A. (CH) 2016-12-22 US claimed
EP-3019034-A2 ORGANIC COMPOUNDS Givaudan SA (CH) 2016-05-18 EP claimed
WO-2015000900-A2 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2015-01-08 WO claimed
US-10178875-B2 Methods of modifying or imparting taste using organic compounds GIVAUDAN S.A. (CH) 2019-01-15 US disclosed
EP-3019034-B1 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2018-10-31 EP disclosed
US-20160366922-A1 ORGANIC COMPOUNDS GIVAUDAN S.A. (CH) 2016-12-22 US disclosed
EP-3019034-A2 ORGANIC COMPOUNDS Givaudan SA (CH) 2016-05-18 EP disclosed
WO-2015000900-A2 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2015-01-08 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 (2 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-10178875-B2 Methods of modifying or imparting taste using organic compounds TAS2R8, OR10J3, TAS2R7 HSD17B10 3240/4885POLB 2972/4885ALDH1A1 1202/4885
US-20160366922-A1 ORGANIC COMPOUNDS OR10J3, TAS2R8, OR51E2 HSD17B10 2920/4885POLB 3191/4885ALDH1A1 1031/4885

“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.