Hydrochloric Acid

Hydrochloric Acid

SCHEMBL1662095

Cl.Cl.NCC(N)(C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1

nearest known ligand 0.46

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 16)

geneUniProtsupporting neighboursconfidence
HTR2A known ✓ P28223 3/20 0.46
HRH1 known ✓ P35367 2/20 0.43
SLC6A4 known ✓ P31645 3/20 0.41
SLC6A3 known ✓ Q01959 3/20 0.41
SLC6A2 known ✓ P23975 2/20 0.41
DPP4 known ✓ P27487 2/20 0.39
TAAR1 Q96RJ0 4/20 0.46
CHRNB2 P17787 1/20 0.39
CHRNA4 P43681 1/20 0.39
F2 P00734 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
TSHR P16473 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL15156585 0.98 TAAR1 (0.48) TAAR1HTR2AHRH1SLC6A4SLC6A3
SCHEMBL10961816 0.79 TAAR1 (0.48) TAAR1HTR2AHRH1SLC6A4SLC6A3
SCHEMBL7525369 0.76 TAAR1 (0.50) TAAR1HTR2AHRH1SLC6A4SLC6A3
SCHEMBL29998636 0.76 TAAR1 (0.45) TAAR1HTR2AHRH1SLC6A4SLC6A3
SCHEMBL10380299 0.76 AOC3 (0.46) TAAR1HTR2AHRH1SLC6A4SLC6A3
SCHEMBL2302238 0.72 DPP4 (0.48) TAAR1HTR2AHRH1DPP4F2
Hydrochloric Acid SCHEMBL17645582 0.70 SLC6A2 (0.41) TAAR1HTR2ASLC6A4SLC6A3SLC6A2
Water SCHEMBL28973054 0.70 TAAR1 (0.48) TAAR1HTR2AHRH1CHRNB2CHRNA4
SCHEMBL352841 0.69 TAAR1 (0.46) TAAR1HTR2ASLC6A4SLC6A3SLC6A2
Hydrochloric Acid SCHEMBL8550503 0.67 HTR2A (0.94) TAAR1HTR2AHRH1SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3310783-A1 METHODS AND COMPOSITIONS FOR THE PREVENTION AND TREATMENT OF HEARING LOSS Zuo, Jian (US) 2018-04-25 EP disclosed
EP-2152752-B1 ANTIBODY DIRECTED TO G PROTEIN COUPLED RECEPTORS (GPCR) HOFFMANN LA ROCHE (CH) 2017-11-08 EP disclosed
WO-2016205806-A1 METHODS AND COMPOSITIONS FOR THE PREVENTION AND TREATMENT OF HEARING LOSS ST. JUDE CHILDREN'S RESEARCH HOSPITAL (US) 2016-12-22 WO disclosed
CN-102105133-B Controlled release otic structure modulating and innate immune system modulating compositions and methods of treating otic disorders OTONOMY INC 2015-06-17 CN disclosed
CN-101687927-B Antibody directed to G protein coupled receptors (GPCR) HOFFMANN LA ROCHE 2013-10-30 CN disclosed
US-8354102-B2 Antibodies directed to mGluR7 HOFFMANN-LA ROCHE INC. (US) 2013-01-15 US disclosed
EP-2490722-A2 MODULATION OF GEL TEMPERATURE OF POLOXAMER-CONTAINING FORMULATIONS Otonomy, Inc. (US) 2012-08-29 EP disclosed
WO-2011049958-A2 MODULATION OF GEL TEMPERATURE OF POLOXAMER-CONTAINING FORMULATIONS OTONOMY, INC. (US) 2011-04-28 WO disclosed
US-20100303802-A1 ANTIBODY DIRECTED TO G PROTEIN COUPLED RECEPTORS (GPCR) F. HOFFMANN-LA ROCHE AG (CH) 2010-12-02 US disclosed
CN-101687927-A antibody directed to g protein coupled receptors (gpcr) HOFFMANN LA ROCHE 2010-03-31 CN disclosed
EP-2152752-A2 ANTIBODY DIRECTED TO G PROTEIN COUPLED RECEPTORS (GPCR) F. Hoffmann-Roche AG (CH) 2010-02-17 EP disclosed
WO-2008138536-A2 ANTIBODY DIRECTED TO G PROTEIN COUPLED RECEPTORS (GPCR) F. HOFFMANN-LA ROCHE AG (CH) 2008-11-20 WO disclosed