Hydrochloric Acid

Hydrochloric Acid

SCHEMBL9596951

CC(C(=O)c1cccc(N)c1)N1CCCCC1.Cl.Cl

nearest known ligand 0.70

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
▸ SLC6A3 known ✓ Q01959 9/20 0.70
▸ SLC6A2 known ✓ P23975 8/20 0.70
▸ CHRNB4 known ✓ P30926 6/20 0.70
▸ CHRNA3 known ✓ P32297 6/20 0.70
▸ CHRNA1 known ✓ P02708 4/20 0.70
▸ CHRNG known ✓ P07510 4/20 0.70
▸ CHRNB1 known ✓ P11230 4/20 0.70
▸ CHRND known ✓ Q07001 4/20 0.70
▸ SLC6A4 known ✓ P31645 3/20 0.68
▸ GAA known ✓ P10253 1/20 0.60
▸ MAOB known ✓ P27338 1/20 0.49
▸ CHRNB2 P17787 6/20 0.70
▸ CHRNA4 P43681 6/20 0.70
▸ ALDH1A1 P00352 2/20 0.60
▸ KDM4E B2RXH2 1/20 0.60
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ ATM Q13315 1/20 0.43
▸ PBRM1 Q86U86 1/20 0.41
▸ NPC1 O15118 1/20 0.40

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
SCHEMBL9595857 0.99 SLC6A3 (0.72) SLC6A3SLC6A2CHRNB4CHRNA3CHRNB2
Hydrochloric Acid SCHEMBL9796810 0.82 SLC6A3 (0.58) SLC6A3SLC6A2CHRNB4CHRNA3CHRNB2
Hydrochloric Acid SCHEMBL9797234 0.82 SLC6A3 (0.58) SLC6A3SLC6A2CHRNB4CHRNA3CHRNB2
Hydrochloric Acid SCHEMBL10728832 0.82 SLC6A2 (0.68) SLC6A3SLC6A2CHRNB4CHRNA3CHRNB2
SCHEMBL634327 0.81 SLC6A2 (1.00) SLC6A3SLC6A2CHRNB4CHRNA3CHRNB2
SCHEMBL9796926 0.80 SLC6A3 (0.60) SLC6A3SLC6A2CHRNB4CHRNA3CHRNB2
Hydrochloric Acid SCHEMBL9596538 0.80 SLC6A3 (0.60) SLC6A3SLC6A2CHRNB4CHRNA3CHRNB2
SCHEMBL9360364 0.80 SLC6A3 (0.60) SLC6A3SLC6A2CHRNB4CHRNA3CHRNB2
SCHEMBL1072701 0.80 SLC6A2 (0.69) SLC6A3SLC6A2CHRNB4CHRNA3CHRNB2
Hydrochloric Acid SCHEMBL22614730 0.80 SLC6A2 (0.65) SLC6A3SLC6A2CHRNB4CHRNA3CHRNB2

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-5236922-A Method for treating depression using 1-(aminophenyl)-2-aminopropanone derivatives LABORATOIRE L. LAFON (FR) 1993-08-17 — — US disclosed
US-4980377-A ANTIDEPRESSANTS, VASODILATION, IMMUNOSTIMULANTS LABORATOIRE L. LAFON (FR) 1990-12-25 — — US disclosed
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