Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5848626

Cc1cc(N)c2cc(N)ccc2[n+]1C.Cl.[Cl-]

nearest known ligand 0.51

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 0.35
PRKCA known ✓ P17252 10/20 0.35
GLA known ✓ P06280 2/20 0.35
ESR1 known ✓ P03372 1/20 0.35
CHRM2 known ✓ P08172 1/20 0.35
HTR1A known ✓ P08908 1/20 0.35
ADRA2A known ✓ P08913 1/20 0.35
CHRM1 known ✓ P11229 1/20 0.35
MAOA known ✓ P21397 1/20 0.35
DRD1 known ✓ P21728 1/20 0.35
PTGS1 known ✓ P23219 1/20 0.35
SLC6A2 known ✓ P23975 1/20 0.35
PDE4A known ✓ P27815 1/20 0.35
SLC6A4 known ✓ P31645 1/20 0.35
ADRA1A known ✓ P35348 1/20 0.35
OPRM1 known ✓ P35372 1/20 0.35
DRD3 known ✓ P35462 1/20 0.35
SLC6A3 known ✓ Q01959 1/20 0.35
KCNH2 known ✓ Q12809 1/20 0.35
PDE3A known ✓ Q14432 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
SCHEMBL6600083 0.96 TERT (0.54) TERTALOX15MEN1KMT2ALMNA
Hydrochloric Acid SCHEMBL6761987 0.78 TERT (0.54) TERTALOX15MEN1KMT2ALMNA
SCHEMBL337016 0.76 PRKCA (0.57) TERTALOX15MEN1KMT2ALMNA
Iodide SCHEMBL336306 0.74 PRKCA (0.58) TERTALOX15MEN1KMT2ALMNA
Iodide SCHEMBL29918121 0.74 PRKCA (0.58) TERTALOX15MEN1KMT2ALMNA
SCHEMBL6952921 0.74 TERT (0.57) TERTALOX15MEN1KMT2ALMNA
Hydrochloric Acid SCHEMBL11705198 0.68 CYP3A4 (0.47) TERTALOX15MEN1KMT2ALMNA
SCHEMBL291198 0.67 TERT (0.67) TERTALOX15MEN1KMT2ACYP3A4
3,6-Diamino-10-Methylacridinium SCHEMBL865113 0.63 MEN1 (0.96) ALOX15MEN1KMT2ALMNAMAPT
3,6-Diamino-10-Methylacridinium SCHEMBL29564469 0.60 MEN1 (1.00) ALOX15MEN1KMT2ALMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060199840-A1 Chemical derivatives and their application as antitelomerase agent AVENTIS PHARMA S.A. (FR) 2006-09-07 US disclosed
US-6995175-B2 Chemical derivatives and their application as antitelomerase agent AVENTIS PHARMA S.A. (FR) 2006-02-07 US disclosed
US-20040138257-A1 Chemical derivatives and their application as antitelomerase agent AVENTIS PHARMA S.A. (FR) 2004-07-15 US disclosed
US-20040053966-A1 Chemical derivatives and their application as antitelomerase agent AVENTIS PHARMS S.A. 2004-03-18 US disclosed
US-6645964-B1 1,3,5-Triazine compounds substituted with aromatic N-heterocycle; anticarcinogenic agents AVENTIS PHARMA S.A. (FR) 2003-11-11 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 (3 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-20040138257-A1 Chemical derivatives and their application as antitelomerase agent NTPCR, DPYD, NME1 ACHE 2888/4885PRKCA 1168/4885GLA 536/4885
US-20040053966-A1 Chemical derivatives and their application as antitelomerase agent NTPCR, DPYD, NME1 ACHE 2715/4885PRKCA 1177/4885GLA 491/4885
US-20060199840-A1 Chemical derivatives and their application as antitelomerase agent NTPCR, DPYD, NME1 ACHE 2888/4885PRKCA 1168/4885GLA 536/4885

“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.