Hydrochloric Acid

Hydrochloric Acid

SCHEMBL1746110

Cl.NCCCCOC(=O)/C=C/c1ccccc1

nearest known ligand 0.61

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 19)

geneUniProtsupporting neighboursconfidence
MAOB known ✓ P27338 1/20 0.52
AKR1B10 O60218 6/20 0.61
AKR1B1 P15121 6/20 0.61
LMNA P02545 3/20 0.56
ALDH1A1 P00352 1/20 0.56
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
APP P05067 4/20 0.52
CA12 O43570 1/20 0.49
CA4 P22748 1/20 0.49
CA6 P23280 1/20 0.49
CA5A P35218 1/20 0.49
CA7 P43166 1/20 0.49
CA9 Q16790 1/20 0.49
CA14 Q9ULX7 1/20 0.49
CA5B Q9Y2D0 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.48
ALOX5 P09917 1/20 0.47
RAB9A P51151 1/20 0.47

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 SCHEMBL1746113 1.00 AKR1B10 (0.61) AKR1B10AKR1B1LMNAALDH1A1MEN1
Hydrochloric Acid SCHEMBL2340300 0.98 AKR1B10 (0.60) AKR1B10AKR1B1LMNAALDH1A1MEN1
Hydrochloric Acid SCHEMBL2340303 0.98 AKR1B10 (0.60) AKR1B10AKR1B1LMNAALDH1A1MEN1
Hydrochloric Acid SCHEMBL1744660 0.98 AKR1B10 (0.60) AKR1B10AKR1B1LMNAALDH1A1MEN1
Hydrochloric Acid SCHEMBL1744661 0.98 AKR1B10 (0.60) AKR1B10AKR1B1LMNAALDH1A1MEN1
Hydrochloric Acid SCHEMBL1744179 0.98 AKR1B10 (0.60) AKR1B10AKR1B1LMNAALDH1A1MEN1
Hydrochloric Acid SCHEMBL1744177 0.98 AKR1B10 (0.60) AKR1B10AKR1B1LMNAALDH1A1MEN1
SCHEMBL7997849 0.98 AKR1B10 (0.63) AKR1B10AKR1B1LMNAALDH1A1MEN1
SCHEMBL7997845 0.98 AKR1B10 (0.63) AKR1B10AKR1B1LMNAALDH1A1MEN1
SCHEMBL8007280 0.97 AKR1B10 (0.61) AKR1B10AKR1B1LMNAALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9616087-B2 Pharmaceutical agent having long-lasting effect of treating arthritic disorders SEIKAGAKU CORPORATION (JP) 2017-04-11 US disclosed
US-9301972-B2 Hyaluronic acid derivatives SEIKAGAKU CORPORATION (JP) 2016-04-05 US disclosed
US-20150283169-A1 PHARMACEUTICAL AGENT HAVING LONG-LASTING EFFECT OF TREATING ARTHRITIC DISORDERS SEIKAGAKU CORPORATION (JP) 2015-10-08 US disclosed
EP-2910248-A1 Pharmaceutical agent having long-lasting effect of treating arthritic disorders SEIKAGAKU CORPORATION (JP) 2015-08-26 EP disclosed
US-20150094280-A1 PHARMACEUTICAL AGENT HAVING LONG-LASTING EFFECT OF TREATING ARTHRITIC DISORDERS SEIKAGAKU CORPORATION (JP) 2015-04-02 US disclosed
US-8889652-B2 Pharmaceutical agent having long-lasting effect of treating arthritic disorders SEIKAGAKU CORPORATION (JP) 2014-11-18 US disclosed
EP-2386306-A1 Pharmaceutical agent having long-lasting effect of treating arthritic disorders SEIKAGAKU CORPORATION (JP) 2011-11-16 EP disclosed
US-20110053885-A1 PHARMACEUTICAL AGENT HAVING LONG-LASTING EFFECT OF TREATING ARTHRITIC DISORDERS SEIKAGAKU CORPORATION (JP) 2011-03-03 US disclosed
EP-2094280-A1 PHARMACEUTICAL AGENT HAVING LONG-LASTING EFFECT OF TREATING ARTHRITIC DISORDERS SEIKAGAKU CORPORATION (JP) 2009-09-02 EP disclosed
WO-2008069348-A9 PHARMACEUTICAL AGENT HAVING LONG-LASTING EFFECT OF TREATING ARTHRITIC DISORDERS SEIKAGAKU KOGYO CO LTD (JP) 2009-08-20 WO disclosed
WO-2008069348-A1 PHARMACEUTICAL AGENT HAVING LONG-LASTING EFFECT OF TREATING ARTHRITIC DISORDERS SEIKAGAKU CORPORATION (JP) 2008-06-12 WO disclosed