Hydrochloric Acid

Hydrochloric Acid

SCHEMBL11479030

Brc1cccc(NC2CCN3CCc4c(n(Cc5ccccc5)c5ccccc45)C3C2)c1.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
▸ HDAC6 known ✓ Q9UBN7 5/20 0.41
▸ HDAC8 known ✓ Q9BY41 3/20 0.41
▸ HDAC2 known ✓ Q92769 2/20 0.41
▸ HTR1A known ✓ P08908 2/20 0.37
▸ HTR2A known ✓ P28223 1/20 0.37
▸ HTR7 known ✓ P34969 1/20 0.37
▸ HTR6 known ✓ P50406 1/20 0.37
▸ GAA known ✓ P10253 1/20 0.36
▸ SIGMAR1 known ✓ Q99720 1/20 0.36
▸ OPRM1 known ✓ P35372 2/20 0.35
▸ KCNH2 known ✓ Q12809 2/20 0.35
▸ CHRM2 known ✓ P08172 1/20 0.35
▸ ADRA2A known ✓ P08913 1/20 0.35
▸ CHRM1 known ✓ P11229 1/20 0.35
▸ DRD1 known ✓ P21728 1/20 0.35
▸ SLC6A2 known ✓ P23975 1/20 0.35
▸ SLC6A4 known ✓ P31645 1/20 0.35
▸ ADRA1A known ✓ P35348 1/20 0.35
▸ DRD3 known ✓ P35462 1/20 0.35
▸ SLC6A3 known ✓ Q01959 1/20 0.35

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 SCHEMBL11470685 0.91 HDAC6 (0.43) HDAC6HDAC8HDAC2HTR1AHTR6
Hydrochloric Acid SCHEMBL11471583 0.90 HDAC6 (0.42) HDAC6HDAC8HDAC2HTR1AHTR2A
SCHEMBL11499454 0.90 HDAC6 (0.44) HDAC6HDAC8HDAC2HTR1AHTR6
Hydrochloric Acid SCHEMBL11468675 0.90 DCUN1D1 (0.40) HDAC6HDAC8HDAC2HTR1AALDH1A1
SCHEMBL11475559 0.89 DCUN1D1 (0.41) HDAC6HDAC8HDAC2HTR1AALDH1A1
SCHEMBL11470640 0.85 HDAC8 (0.42) HDAC6HDAC8HDAC2ALDH1A1KMT2A
SCHEMBL11467279 0.85 SIGMAR1 (0.41) HDAC6HDAC8HDAC2ALDH1A1SIGMAR1
Oxalic Acid SCHEMBL11470690 0.83 HDAC8 (0.41) HDAC6HDAC8HDAC2ALDH1A1KMT2A
Hydrochloric Acid SCHEMBL11486433 0.82 SSTR5 (0.42) HDAC6HDAC8HDAC2HTR1AHTR2A
SCHEMBL11498371 0.81 SSTR5 (0.42) HDAC6HDAC8HDAC2HTR1AHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4181657-A 2-Aminooctahydroindolo[2,3-a]quinolizines useful in treating cardiovascular disorders MILES LABORATORIES, INC. (US) 1980-01-01 — — US claimed
US-4181657-A 2-Aminooctahydroindolo[2,3-a]quinolizines useful in treating cardiovascular disorders MILES LABORATORIES, INC. (US) 1980-01-01 — — US disclosed
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