Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5200635

COC(=O)C1CN2CCC1CC2.Cl

nearest known ligand 0.96

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 9)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 known ✓ P08172 4/20 0.46
▸ CHRM1 known ✓ P11229 3/20 0.46
▸ CHRM4 known ✓ P08173 1/20 0.46
▸ CHRM5 known ✓ P08912 1/20 0.46
▸ CHRM3 known ✓ P20309 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.49
▸ MEN1 O00255 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ KMT2A Q03164 1/20 0.46

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
SCHEMBL6965129 0.98 CHRM2 (0.47) ALDH1A1CHRM2CHRM1CHRM4CHRM5
SCHEMBL7266907 0.89 CHRM1 (0.49) CHRM2CHRM1CHRM4CHRM3
Hydrochloric Acid SCHEMBL11442910 0.87 ALDH1A1 (0.40) ALDH1A1CHRM2CHRM1CHRM4CHRM5
SCHEMBL10369501 0.87 CHRM1 (0.51) CHRM2CHRM1CHRM4CHRM3
Oxalic Acid SCHEMBL10367531 0.84 CHRM1 (0.45) CHRM2CHRM1CHRM4CHRM3
Hydrochloric Acid SCHEMBL4322280 0.81 ALDH1A1 (0.45) ALDH1A1CHRM2CHRM1CHRM4CHRM5
SCHEMBL3314224 0.78 CHRM1 (0.40) CHRM2CHRM1CHRM4CHRM3
SCHEMBL9696817 0.78 ALDH1A1 (0.46) ALDH1A1CHRM2CHRM1CHRM4CHRM5
Hydrochloric Acid SCHEMBL9444152 0.78 ALDH1A1 (0.53) ALDH1A1CHRM2CHRM1CHRM4CHRM5
SCHEMBL8872327 0.77 SLC6A2 (0.36) CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070197594-A1 Cyclic amine derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2007-08-23 — — US disclosed
EP-1795524-A1 CYCLIC AMINE DERIVATIVE OR SALT THEREOF Astellas Pharma Inc. (JP) 2007-06-13 — — EP disclosed
US-5686463-A Oxadiazoles useful in the treatment of senile dementia MERCK, SHARP & DOHME, LTD. (GB) 1997-11-11 — — US disclosed
EP-0239309-B1 Oxadiazoles useful in the treatment of senile dementia MERCK SHARP & DOHME (GB) 1994-01-12 — — EP disclosed
US-5262427-A Cognition activators for Alzheimer*s disease NOVO NORDISK A/S (DK) 1993-11-16 — — US disclosed
US-5073557-A Cognition activators, stimulants of central muscarinic acetylc holine receptors MERCK SHARP & DOHME LIMITED (GB) 1991-12-17 — — US disclosed
EP-0416754-A2 A novel substituted pyrazine, formulations thereof and use in medicine MERCK SHARP & DOHME LTD. (GB) 1991-03-13 — — EP disclosed
US-4925942-A Preparation of quinuclidine-3-methanol RUTGERSWERKE AG (DE) 1990-05-15 — — US disclosed
EP-0239309-A2 Oxadiazoles useful in the treatment of senile dementia MERCK SHARP & DOHME LTD. (GB) 1987-09-30 — — EP disclosed
US-4525475-A Prevention of thrombolic disorder with imidazole derivatives and salts thereof THOROGOOD PETER B (GB) 1985-06-25 — — US disclosed
EP-0015002-B1 1-SUBSTITUTED IMIDAZOLES, AND SALTS THEREOF, A METHOD FOR THEIR PREPARATION AND PHARMACEUTICAL FORMULATIONS THEREOF THE WELLCOME FOUNDATION LIMITED (GB) 1984-04-18 — — EP disclosed
US-4328234-A Imidazole derivatives and salts thereof and pharmaceutical formulations useful in thrombo-embolic disorders BURROUGHS WELLCOME CO. (US) 1982-05-04 — — US disclosed
EP-0015002-A1 1-substituted imidazoles, and salts thereof, a method for their preparation and pharmaceutical formulations thereof THE WELLCOME FOUNDATION LIMITED (GB) 1980-09-03 — — EP 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-20070197594-A1 Cyclic amine derivative or salt thereof GRIN1, PARK7, GRIN3A CHRM2 518/4885CHRM1 80/4885CHRM4 620/4885

“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.

Send feedback