Hydrochloric Acid

Hydrochloric Acid

SCHEMBL1722152

C[C@@H](O)[C@H](O)[C@H](O)[C@@H](N)C=O.Cl

nearest known ligand 0.43

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 1)

geneUniProtsupporting neighboursconfidence
PAX8 Q06710 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
SCHEMBL9504052 0.97 PAX8 (0.44) PAX8
SCHEMBL3158180 0.97 PAX8 (0.44) PAX8
SCHEMBL4459290 0.97 PAX8 (0.44) PAX8
SCHEMBL29425221 0.97 PAX8 (0.44) PAX8
SCHEMBL489573 0.97 PAX8 (0.44) PAX8
SCHEMBL476387 0.97 PAX8 (0.44) PAX8
SCHEMBL3899055 0.97 PAX8 (0.44) PAX8
SCHEMBL9504057 0.97 PAX8 (0.44) PAX8
SCHEMBL14151119 0.95 PAX8 (0.43) PAX8
SCHEMBL11403360 0.95 PAX8 (0.43) PAX8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2404894-B1 Mevalonic Acid Derivatives OHGEN RES LAB LTD (JP) 2013-09-11 EP disclosed
EP-2404894-A1 Mevalonic Acid Derivatives Ohgen Research Laboratories Ltd. (JP) 2012-01-11 EP disclosed
EP-2399900-A1 Geranyl compounds Ohgen Research Laboratories Ltd. (JP) 2011-12-28 EP disclosed
EP-2399899-A1 Geranyl compounds Ohgen Research Laboratories Ltd. (JP) 2011-12-28 EP disclosed
EP-1471052-B1 GERANYL COMPOUNDS OHGEN RES LAB LTD (JP) 2011-08-10 EP disclosed
US-7579376-B2 N-geranoyltyrosine and N-geranoylcycteine as excellant antitumor and anticarcinogenic agents OHGEN RESEARCH LABORATORIES, LTD. (JP) 2009-08-25 US disclosed
US-7553820-B2 Mevalonic acid derivatives OHGEN RESEARCH LABORATORIES, LTD. (JP) 2009-06-30 US disclosed
US-7507765-B2 Geranyl compounds OHGEN RESEARCH LABORATORIES, LTD. (JP) 2009-03-24 US disclosed
US-20080119556-A1 Geranly compounds AKIYAMA KIYOSHI 2008-05-22 US disclosed
US-20080113939-A1 Geranyl compounds AKIYAMA KIYOSHI 2008-05-15 US disclosed
CN-100362010-C Mevalonic acid derivative OHGEN RESEACH LAB LTD (JP) 2008-01-16 CN disclosed
CN-1307148-C Compound containing geranyl OHGEN RES LAB LTD (JP) 2007-03-28 CN disclosed
US-7125852-B2 Geranyl compounds OHGEN RESEARCH LABORATORIES, LTD. (JP) 2006-10-24 US disclosed
US-20060142244-A1 Geranyl compounds AKIYAMA KIYOSHI 2006-06-29 US disclosed
CN-1781927-A Mevalonic acid derivative OHGEN RESEACH LAB LTD (JP) 2006-06-07 CN disclosed
US-20050119474-A1 Geranyl compounds OHGEN RESEARCH LABORATORIES, LTD. (JP) 2005-06-02 US disclosed
CN-1612857-A Compound containing geranyl OHGEN RES LAB LTD (JP) 2005-05-04 CN disclosed
EP-1471052-A1 GERANYL COMPOUNDS Ohgen Research Laboratories Ltd. (JP) 2004-10-27 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 (4 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-20080113939-A1 Geranyl compounds GGPS1, FNTA, CCNE2 PAX8 4072/4885
US-20080119556-A1 Geranly compounds GMNN, TP53, MCL1 PAX8 3554/4885
US-20060142244-A1 Geranyl compounds GGPS1, FNTA, CCNE2 PAX8 4072/4885
US-20050119474-A1 Geranyl compounds GGPS1, FNTA, CCNE2 PAX8 4072/4885

“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.