Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3198033

CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC(O)[C@]4(C)[C@H]3CC[C@]12C.Cl

nearest known ligand 0.66

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
NR3C1 known ✓ P04150 3/20 0.66
SIGMAR1 known ✓ Q99720 3/20 0.66
CHRM2 known ✓ P08172 1/20 0.66
CHRM1 known ✓ P11229 1/20 0.66
HTR2A known ✓ P28223 1/20 0.66
ADRA1A known ✓ P35348 1/20 0.66
HTR2B known ✓ P41595 1/20 0.66
PDE3A known ✓ Q14432 1/20 0.66
HSD11B1 known ✓ P28845 2/20 0.53
CYP19A1 known ✓ P11511 3/20 0.52
CACNA1C known ✓ Q13936 2/20 0.52
CYP3A4 P08684 6/20 0.66
LMNA P02545 6/20 0.66
SERPINA6 P08185 6/20 0.66
SMN1; SMN2 Q16637 5/20 0.66
TSHR P16473 4/20 0.66
MAPT P10636 4/20 0.66
MAPK1 P28482 4/20 0.66
ALDH1A1 P00352 4/20 0.66
GPBAR1 Q8TDU6 4/20 0.66

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
SCHEMBL1457788 0.99 CYP3A4 (0.67) CYP3A4LMNASERPINA6SMN1; SMN2TSHR
SCHEMBL5436459 0.99 CYP3A4 (0.67) CYP3A4LMNASERPINA6SMN1; SMN2TSHR
SCHEMBL8069 0.99 CYP3A4 (0.67) CYP3A4LMNASERPINA6SMN1; SMN2TSHR
SCHEMBL3509140 0.99 CYP3A4 (0.67) CYP3A4LMNASERPINA6SMN1; SMN2TSHR
SCHEMBL571703 0.99 CYP3A4 (0.67) CYP3A4LMNASERPINA6SMN1; SMN2TSHR
SCHEMBL25333984 0.99 CYP3A4 (0.67) CYP3A4LMNASERPINA6SMN1; SMN2TSHR
SCHEMBL4747200 0.99 CYP3A4 (0.67) CYP3A4LMNASERPINA6SMN1; SMN2TSHR
SCHEMBL2724646 0.99 CYP3A4 (0.67) CYP3A4LMNASERPINA6SMN1; SMN2TSHR
SCHEMBL3661927 0.99 CYP3A4 (0.67) CYP3A4LMNASERPINA6SMN1; SMN2TSHR
Bicarbonate SCHEMBL6684636 0.97 CYP3A4 (0.65) CYP3A4LMNASERPINA6SMN1; SMN2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7671044-B2 Pharmaceutical formula for treating skin disease KLEVER MODE, S.L. (ES) 2010-03-02 US disclosed
EP-1891960-B1 Pharmaceutical formula for treating skin disease KLEVER MODE S L (ES) 2009-09-30 EP disclosed
EP-1891960-A1 Pharmaceutical formula for treating skin disease Klever Mode, S.L. (ES) 2008-02-27 EP disclosed
US-20080045487-A1 Pharmaceutical formula for treating skin disease KLEVER MODE, S.L. (ES) 2008-02-21 US disclosed