Hydrochloric Acid

Hydrochloric Acid

SCHEMBL28376010

Brc1ccccc1N(c1ccccc1Br)c1ccccc1Br.Cl.Cl.Cl.Cl.Cl.Cl

nearest known ligand 0.41

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
ESR1 known ✓ P03372 2/20 0.34
CA2 known ✓ P00918 1/20 0.33
GAA known ✓ P10253 1/20 0.32
HTR2A known ✓ P28223 2/20 0.32
HTR2C known ✓ P28335 2/20 0.32
HTR2B known ✓ P41595 2/20 0.32
HRH3 known ✓ Q9Y5N1 2/20 0.32
HTR7 known ✓ P34969 1/20 0.30
ALDH1A1 P00352 3/20 0.39
MAPK1 P28482 1/20 0.36
IDO1 P14902 2/20 0.34
TAAR1 Q96RJ0 2/20 0.33
CA1 P00915 1/20 0.33
CA4 P22748 1/20 0.33
CA6 P23280 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
KDM1A O60341 1/20 0.33
PLCG1 P19174 1/20 0.31
LMNA P02545 1/20 0.31
BLM P54132 1/20 0.31

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
SCHEMBL1874023 0.97 ALDH1A1 (0.41) ALDH1A1MAPK1IDO1ESR1TAAR1
SCHEMBL30631792 0.97 ALDH1A1 (0.41) ALDH1A1MAPK1IDO1ESR1TAAR1
SCHEMBL30282355 0.81 ALDH1A1 (0.41) ALDH1A1MAPK1ESR1TDP1TSHR
SCHEMBL1168198 0.81 ALDH1A1 (0.41) ALDH1A1MAPK1ESR1TDP1TSHR
SCHEMBL1330156 0.81 ALDH1A1 (0.41) ALDH1A1MAPK1ESR1TDP1TSHR
SCHEMBL20186660 0.81 ESR1 (0.35) ALDH1A1MAPK1ESR1TAAR1CA1
Hydrochloric Acid SCHEMBL27838096 0.80 ALDH1A1 (0.38) ALDH1A1MAPK1IDO1ESR1TAAR1
SCHEMBL5730842 0.80 ALDH1A1 (0.38) ALDH1A1MAPK1IDO1ESR1TAAR1
SCHEMBL15377824 0.79 ALDH1A1 (0.39) ALDH1A1MAPK1ESR1TDP1TSHR
Hydrochloric Acid SCHEMBL2872399 0.78 MAPT (0.43) ALDH1A1MAPK1ESR1TAAR1CA2

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108604643-B Organic electroluminescent element 保土谷化学工业株式会社 2022-02-15 CN claimed
CN-115210899-A Organic electroluminescent element 保土谷化学工业株式会社 2022-10-18 CN disclosed
CN-115003729-A High molecular weight compound and light emitting diode containing the same 保土谷化学工业株式会社 2022-09-02 CN disclosed
CN-114981991-A Organic electroluminescent element 保土谷化学工业株式会社 2022-08-30 CN disclosed
CN-114946273-A Organic electroluminescent element 保土谷化学工业株式会社 2022-08-26 CN disclosed
CN-114867713-A Arylamine compound and organic electroluminescent element 保土谷化学工业株式会社 2022-08-05 CN disclosed
CN-110431680-B Organic electroluminescent element 保土谷化学工业株式会社 2022-07-08 CN disclosed
CN-109844978-B Indenocarbazole compound and organic electroluminescent element 保土谷化学工业株式会社 2022-06-14 CN disclosed
CN-114586189-A Organic electroluminescent element 保土谷化学工业株式会社 2022-06-03 CN disclosed
CN-108604643-B Organic electroluminescent element 保土谷化学工业株式会社 2022-02-15 CN disclosed
CN-111869326-A Organic electroluminescent element and method for manufacturing the same 保土谷化学工业株式会社 2020-10-30 CN disclosed
CN-111567141-A Organic EL element, amine compound having benzoxazole ring structure, and method for using same in capping layer of organic EL element 保土谷化学工业株式会社 2020-08-21 CN disclosed
CN-111344879-A Organic electroluminescent element 保土谷化学工业株式会社 2020-06-26 CN disclosed
CN-111316462-A Compound having indenocarbazole ring structure and organic electroluminescent element 保土谷化学工业株式会社 2020-06-19 CN disclosed
CN-108369994-B Organic electroluminescent element 保土谷化学工业株式会社 2020-05-19 CN disclosed
CN-111164778-A Organic electroluminescent element 保土谷化学工业株式会社 2020-05-15 CN disclosed
CN-111095588-A Organic electroluminescent element 保土谷化学工业株式会社 2020-05-01 CN disclosed
CN-111094264-A Compound having pyrimidine ring structure and organic electroluminescent element 保土谷化学工业株式会社 2020-05-01 CN disclosed
CN-110998889-A Organic electroluminescent element containing compound having benzoxazole ring structure 保土谷化学工业株式会社 2020-04-10 CN disclosed
CN-110776515-A Compound having azaindeno [1, 2, c ] phenanthrene ring structure and organic electroluminescent element using same 保土谷化学工业株式会社 2020-02-11 CN disclosed