Hydrochloric Acid

Hydrochloric Acid

SCHEMBL28544719

CC1=C(C)C(C)(C)C([Ti]Oc2cccc3ccccc23)=C1C.Cl.Cl

nearest known ligand 0.35

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
HTR1B known ✓ P28222 9/20 0.34
GAA known ✓ P10253 1/20 0.34
PTGS1 known ✓ P23219 1/20 0.34
HTR1D known ✓ P28221 1/20 0.34
SLC6A4 known ✓ P31645 2/20 0.33
HRH1 known ✓ P35367 1/20 0.33
KCNA3 known ✓ P22001 1/20 0.32
ALDH1A1 P00352 4/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HSD17B10 Q99714 2/20 0.34
PGR P06401 1/20 0.34
MAPK1 P28482 1/20 0.34
KDM4E B2RXH2 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
APEX1 P27695 1/20 0.33
HTT P42858 1/20 0.33

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 SCHEMBL3615426 0.82 MEN1 (0.33) ALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL461532 0.77 NISCH (0.32) ALDH1A1HSD17B10GAAKDM4ETDP1
Hydrochloric Acid SCHEMBL3625539 0.77 MAPK1 (0.36) ALDH1A1MAPK1KDM4ETDP1HRH1
Hydrochloric Acid SCHEMBL392239 0.74 LMNA (0.31) LMNA
SCHEMBL5709976 0.68 FAAH (0.32) PTGS1LMNAHPGD
SCHEMBL28564274 0.67 HTR1B (0.33) HTR1BALDH1A1MEN1KMT2AHSD17B10
SCHEMBL7954037 0.66 HTR1B (0.48) HTR1BALDH1A1MEN1KMT2AHSD17B10
SCHEMBL28544714 0.66 HTR1B (0.36) HTR1BALDH1A1HSD17B10PGRGAA
Hydrochloric Acid SCHEMBL28550633 0.65 SLC6A4 (0.40) HTR1BALDH1A1MEN1KMT2AHSD17B10
Hydrochloric Acid SCHEMBL715988 0.62

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112661892-B Polymerization system and polymerization method for copolymerization of ethylene and cycloolefin and copolymer obtained by polymerization method 中国石油化工股份有限公司 2022-10-21 CN claimed
CN-112661785-B Naphthyloxy single metallocene transition metal compound, catalyst composition containing naphthoxy single metallocene transition metal compound and application of catalyst composition 中国石油化工股份有限公司 2022-10-21 CN claimed
CN-112661886-B Styrene polymerization system and polymerization method and obtained polystyrene 中国石油化工股份有限公司 2022-12-13 CN disclosed
CN-112661892-B Polymerization system and polymerization method for copolymerization of ethylene and cycloolefin and copolymer obtained by polymerization method 中国石油化工股份有限公司 2022-10-21 CN disclosed
CN-112661785-B Naphthyloxy single metallocene transition metal compound, catalyst composition containing naphthoxy single metallocene transition metal compound and application of catalyst composition 中国石油化工股份有限公司 2022-10-21 CN disclosed
CN-112661892-A Polymerization system and polymerization method for copolymerization of ethylene and cycloolefin and copolymer obtained by polymerization method 中国石油化工股份有限公司 2021-04-16 CN disclosed
CN-112661785-A Naphthyloxy single metallocene transition metal compound, catalyst composition containing naphthoxy single metallocene transition metal compound and application of catalyst composition 中国石油化工股份有限公司 2021-04-16 CN disclosed
CN-112661886-A Styrene polymerization system and polymerization method and obtained polystyrene 中国石油化工股份有限公司 2021-04-16 CN disclosed