Hydrochloric Acid

Hydrochloric Acid

SCHEMBL859872

C=CCN(CC=C)Cc1cccc(C)c1C.Cl

nearest known ligand 0.50

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 1/20 0.50
ESR2 known ✓ Q92731 1/20 0.50
OPRM1 known ✓ P35372 3/20 0.37
OPRD1 known ✓ P41143 3/20 0.37
OPRK1 known ✓ P41145 3/20 0.37
BCHE known ✓ P06276 3/20 0.36
SLC6A4 known ✓ P31645 5/20 0.35
SLC6A2 known ✓ P23975 4/20 0.35
SLC6A3 known ✓ Q01959 3/20 0.35
GRIN2D known ✓ O15399 1/20 0.34
GRIN3B known ✓ O60391 1/20 0.34
GRIN1 known ✓ Q05586 1/20 0.34
GRIN2A known ✓ Q12879 1/20 0.34
GRIN2B known ✓ Q13224 1/20 0.34
GRIN2C known ✓ Q14957 1/20 0.34
GRIN3A known ✓ Q8TCU5 1/20 0.34
MAPT P10636 2/20 0.43
KDM4E B2RXH2 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL11526249 0.83 MAPT (0.50) MAPTKDM4EL3MBTL1ALDH1A1LMNA
SCHEMBL14877314 0.83 ESR1 (0.46) ESR1ESR2MAPTKDM4EL3MBTL1
Hydrochloric Acid SCHEMBL933510 0.81 MAPT (0.53) MAPTKDM4EL3MBTL1ALDH1A1LMNA
SCHEMBL2121111 0.79 MAPT (0.50) MAPTKDM4EL3MBTL1ALDH1A1LMNA
SCHEMBL194697 0.79 BCHE (0.42) ESR1ESR2MAPTKDM4EL3MBTL1
Hydrochloric Acid SCHEMBL28962287 0.77 GABRA1 (0.47) ESR1ESR2MAPTL3MBTL1ALDH1A1
SCHEMBL11667015 0.76 ALDH1A1 (0.56) KDM4EL3MBTL1ALDH1A1LMNAHTT
Hydrochloric Acid SCHEMBL11352010 0.76 GABRA1 (0.46) ESR1ESR2MAPTKDM4EL3MBTL1
SCHEMBL170383 0.75 GABRA1 (0.48) ESR1ESR2MAPTL3MBTL1ALDH1A1
SCHEMBL1733365 0.75 GABRA1 (0.48) ESR1ESR2MAPTL3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230086736-A1 MICROEMULSION-BASED VACCINE DELIVERY SYSTEM, PREPARATION METHOD THEREFOR AND USE THEREOF SICHUAN UNIVERSITY (CN) 2023-03-23 US disclosed
EP-4098250-A1 MICROEMULSION-BASED VACCINE DELIVERY SYSTEM, PREPARATION METHOD THEREFOR AND USE THEREOF Sichuan University (CN) 2022-12-07 EP disclosed
US-10844145-B2 Method for producing an electrode material EVONIK OPERATIONS GMBH (DE) 2020-11-24 US disclosed
WO-2020017631-A1 POLYMER PARTICLES AND METHOD FOR PRODUCING POLYMER PARTICLES 株式会社クラレ 2020-01-23 WO disclosed
EP-3464392-B1 METHOD FOR PRODUCING AN ELECTRODE MATERIAL EVONIK OPERATIONS GMBH (DE) 2019-12-18 EP disclosed
US-20190177445-A1 METHOD FOR PRODUCING AN ELECTRODE MATERIAL EVONIK DEGUSSA GMBH (DE) 2019-06-13 US disclosed
US-8779087-B2 Method for producing aliphatic polycarbonate SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2014-07-15 US disclosed
EP-1752474-B1 METHOD FOR PRODUCING CROSSLINKED POLY(METH)ACRYLATE COMPOUND SUMITOMO SEIKA CHEMICALS (JP) 2013-06-12 EP disclosed
US-20120123066-A1 METHOD FOR PRODUCING ALIPHATIC POLYCARBONATE SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2012-05-17 US disclosed
EP-2433976-A1 METHOD FOR PRODUCING ALIPHATIC POLYCARBONATE Sumitomo Seika Chemicals CO. LTD. (JP) 2012-03-28 EP disclosed
US-7816457-B2 Method for producing crosslinked poly(meth)acrylate compound SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2010-10-19 US disclosed
US-20080319149-A1 Method for Producing Crosslinked Poly (Meth) Acrylate Compound SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2008-12-25 US disclosed
EP-1752474-A1 METHOD FOR PRODUCING CROSSLINKED POLY(METH)ACRYLATE COMPOUND SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2007-02-14 EP disclosed