Hydrochloric Acid

Hydrochloric Acid

SCHEMBL10949429

Cl.O=C(CCCN1CCc2sc3ccccc3c(=O)c2C1)c1ccc(F)cc1

nearest known ligand 0.59

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
▸ DRD2 known ✓ P14416 4/20 0.57
▸ HTR2A known ✓ P28223 3/20 0.57
▸ HTR2B known ✓ P41595 3/20 0.57
▸ HRH1 known ✓ P35367 2/20 0.57
▸ DRD3 known ✓ P35462 2/20 0.57
▸ HTR1A known ✓ P08908 1/20 0.57
▸ HTR7 known ✓ P34969 1/20 0.57
▸ HTR2C known ✓ P28335 2/20 0.48
▸ CACNA1F known ✓ O60840 1/20 0.48
▸ CHRM4 known ✓ P08173 1/20 0.48
▸ CHRM5 known ✓ P08912 1/20 0.48
▸ ADRA2A known ✓ P08913 1/20 0.48
▸ ADRA2B known ✓ P18089 1/20 0.48
▸ ADRA2C known ✓ P18825 1/20 0.48
▸ DRD1 known ✓ P21728 1/20 0.48
▸ ADRA1D known ✓ P25100 1/20 0.48
▸ SCN1A known ✓ P35498 1/20 0.48
▸ CACNA1D known ✓ Q01668 1/20 0.48
▸ KCNH2 known ✓ Q12809 1/20 0.48
▸ CACNA1S known ✓ Q13698 1/20 0.48

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
SCHEMBL10950591 0.99 DRD2 (0.58) DRD2HTR2AHTR2BHRH1DRD3
Hydrochloric Acid SCHEMBL10947135 0.79 ADRA2A (0.45) DRD2DRD3KDM4EHSD17B10MEN1
Hydrochloric Acid SCHEMBL10947161 0.79 ADRA2A (0.48) DRD2DRD3HTR1AHTR7KDM4E
Hydrochloric Acid SCHEMBL10946429 0.78 ADRA2A (0.48) DRD2HTR2AHTR2BHRH1DRD3
SCHEMBL10799633 0.78 ADRA2A (0.49) DRD2DRD3HTR1AHTR7KDM4E
Hydrochloric Acid SCHEMBL10949363 0.77 HTR1A (0.48) HTR1AHTR7MEN1ADRA2ACYP2D6
SCHEMBL10800854 0.77 ADRA2A (0.48) DRD2DRD3HTR1AHTR7MEN1
Hydrochloric Acid SCHEMBL10946399 0.77 ADRA2A (0.50) DRD2DRD3KDM4EMEN1LMNA
SCHEMBL11130852 0.76 HTR1A (0.49) HTR1AHTR7MEN1ADRA2ACYP2D6
SCHEMBL10801493 0.76 ADRA2A (0.51) DRD2DRD3KDM4EMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4547507-A ANTIDEPRESSANTS ROUSSEL UCLAF (FR) 1985-10-15 — — US disclosed
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