Hydrochloric Acid

Hydrochloric Acid

SCHEMBL668040

C=CCc1ccccc1C(N)(CC=C)CC=C.Cl

nearest known ligand 0.44

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 14)

geneUniProtsupporting neighboursconfidence
GABRA1 known ✓ P14867 2/20 0.38
GABRB2 known ✓ P47870 2/20 0.38
HTT P42858 1/20 0.34
AKR1B1 P15121 1/20 0.33
ALDH1A1 P00352 3/20 0.33
TSHR P16473 1/20 0.33
IDO1 P14902 1/20 0.33
ICAM1 P05362 1/20 0.32
SELE P16581 1/20 0.32
VCAM1 P19320 1/20 0.32
KDM4E B2RXH2 2/20 0.31
LMNA P02545 1/20 0.31
PMP22 Q01453 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL144630 0.98 GABRA1 (0.39) GABRA1GABRB2HTTAKR1B1ALDH1A1
Water SCHEMBL2836979 0.96 GABRA1 (0.38) GABRA1GABRB2HTTAKR1B1ALDH1A1
Bromide SCHEMBL4908296 0.96 GABRA1 (0.38) GABRA1GABRB2HTTAKR1B1ALDH1A1
Hydrochloric Acid SCHEMBL10751108 0.85 GABRA1 (0.39) GABRA1GABRB2AKR1B1
SCHEMBL10614506 0.83 GABRA1 (0.40) GABRA1GABRB2AKR1B1
SCHEMBL11667013 0.82 HTT (0.41) HTTALDH1A1TSHR
Hydrochloric Acid SCHEMBL11501232 0.81 GABRA1 (0.39) GABRA1GABRB2AKR1B1ALDH1A1TSHR
SCHEMBL11056233 0.81 GABRA1 (0.41) GABRA1GABRB2HTTAKR1B1ALDH1A1
Hydrochloric Acid SCHEMBL170004 0.80 GABRA1 (0.39) GABRA1GABRB2ALDH1A1TSHRIDO1
Iodide SCHEMBL19307326 0.79 GABRA1 (0.36) GABRA1GABRB2HTTALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0208263-B1 Process for the preparation of 1-oxa-3,8-diaza-4-spiro[4,5]decane compounds HOECHST AKTIENGESELLSCHAFT (DE) 1989-09-06 EP claimed
EP-0208264-B1 1-Oxa-3-oxo-4,8-diaza-spiro[4,5]decane compounds HOECHST AKTIENGESELLSCHAFT (DE) 1989-08-23 EP claimed
EP-0208265-B1 1-Oxa-3,8-diaza-4-oxo-spiro[4,5]decane compounds and process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1989-08-23 EP claimed
US-4755602-A Process for preparing 1-oxa-3,8-diaza-4-oxo-spiro-[4,5]-decanes HOECHST AKTIENGESELLSCHAFT (DE) 1988-07-05 US claimed
US-3933768-A RUBBER BLENDS BRIDGESTONE TIRE COMPANY LIMITED (JA) 1976-01-20 US claimed
WO-2023282038-A1 METHOD FOR PRODUCING PAPERMAKING SIZING AGENT 星光PMC株式会社 2023-01-12 WO disclosed
CN-115125734-A Water-dispersible composition for fiber processing 荒川化学工业株式会社 2022-09-30 CN disclosed
CN-110546231-B Tire puncture sealant 横滨橡胶株式会社 2022-09-02 CN disclosed
CN-109790441-B Tire puncture repair material and tire puncture repair kit 横滨橡胶株式会社 2022-04-08 CN disclosed
CN-109790440-B Tire puncture repair material and tire puncture repair kit 横滨橡胶株式会社 2022-04-08 CN disclosed
CN-109312210-B Sealant for tire puncture and repair kit for tire puncture 横滨橡胶株式会社 2021-07-09 CN disclosed
CN-112779782-A Water repellent composition, water repellent fiber product, and method for producing water repellent fiber product 荒川化学工业株式会社 2021-05-11 CN disclosed
EP-0537682-A1 Rosin emulsion sizing agent, paper sized therewith and method of sizing using the same JAPAN PMC CORPORATION (JP) 1993-04-21 EP disclosed
US-4943608-A EFFECTIVE IN HIGH TEMPERATURE, HIGH WATER HARDNESS PAPERMAKING SYSTEM DIC-HERCULES CHEMICALS, INC. (JP) 1990-07-24 US disclosed
US-4858083-A Color changeable photo-decorative pencil torch WAKIMOTO YASUO (JP) 1989-08-15 US disclosed
EP-0323193-A2 Color changeable photo-decorative pencil torch Wakimoto, Yasuo (JP) 1989-07-05 EP disclosed
EP-0021631-B1 CARPET CLEANING AND DEODORISING COMPOSITIONS AND THEIR USE UNITED STATES BORAX & CHEMICAL CORPORATION (US) 1983-11-23 EP disclosed
US-4244834-A Carpet cleaning and deodorizing compositions UNITED STATES BORAX & CHEMICAL CORPORATION (US) 1981-01-13 US disclosed
EP-0021631-A1 Carpet cleaning and deodorising compositions and their use UNITED STATES BORAX & CHEMICAL CORPORATION (US) 1981-01-07 EP disclosed
US-3933768-A RUBBER BLENDS BRIDGESTONE TIRE COMPANY LIMITED (JA) 1976-01-20 US disclosed