Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7929096

Cc1ccc(C(=O)CCN2CCN(C)CC2)cc1.Cl.Cl

nearest known ligand 0.62

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 18)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.62
▸ THRA P10827 1/20 0.58
▸ THRB P10828 1/20 0.58
▸ KMT2A Q03164 11/20 0.56
▸ ALDH1A1 P00352 9/20 0.56
▸ LMNA P02545 5/20 0.56
▸ MAPT P10636 5/20 0.56
▸ HTT P42858 4/20 0.56
▸ HPGD P15428 1/20 0.56
▸ MEN1 O00255 3/20 0.55
▸ POLB P06746 1/20 0.55
▸ RAD52 P43351 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ GFER P55789 1/20 0.54
▸ MPI P34949 1/20 0.52
▸ USP2 O75604 1/20 0.52
▸ TP53 P04637 1/20 0.52
▸ HSD17B10 Q99714 1/20 0.52

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
SCHEMBL1140551 0.87 ALDH1A1 (0.68) TSHRTHRATHRBKMT2AALDH1A1
Hydrochloric Acid SCHEMBL7930370 0.86 KMT2A (0.69) TSHRTHRATHRBKMT2AALDH1A1
Hydrochloric Acid SCHEMBL7930364 0.86 TSHR (0.61) TSHRTHRATHRBKMT2AALDH1A1
Hydrochloric Acid SCHEMBL7934853 0.86 ALDH1A1 (0.71) TSHRTHRATHRBKMT2AALDH1A1
SCHEMBL12123614 0.85 ALDH1A1 (0.71) TSHRTHRATHRBKMT2AALDH1A1
Hydrochloric Acid SCHEMBL7932173 0.85 KMT2A (0.73) TSHRKMT2AALDH1A1MAPTGFER
Hydrochloric Acid SCHEMBL7932182 0.84 ALDH1A1 (0.74) THRATHRBKMT2AALDH1A1LMNA
SCHEMBL5954175 0.84 KMT2A (0.70) TSHRTHRATHRBKMT2AALDH1A1
SCHEMBL3893679 0.83 KMT2A (0.73) KMT2AALDH1A1MAPTGFER
SCHEMBL2616297 0.83 KMT2A (0.76) TSHRKMT2AALDH1A1LMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3009473-B2 — — 2000-02-14 — — JP claimed
US-5705501-A ADMINISTERING TO INHIBIT FORMATION OF ABNORMAL PHOSPHORYLATED PAIRED HELICAL FILAMENT EPITOPES MOLECULAR GERIATRICS CORPORATION (US) 1998-01-06 — — US claimed
EP-0792151-A2 USE OF SUBSTITUTED ARYL-MORPHOLINO-, THIOMORPHOLINO- OR PIPERAZINO-PROPANONES FOR THE TREATEMENT OF PREVENTION OF ALZHEIMER'DISEASE MOLECULAR GERIATRICS CORPORATION (US) 1997-09-03 — — EP claimed
WO-1996015791-A2 USE OF SUBSTITUTED ARYL-MORPHOLINO-, THIOMORPHOLINO- OR PIPERAZINO-PROPANONES FOR THE TREATEMENT OF PREVENTION OF ALZHEIMER'DISEASE MOLECULAR GERIATRICS CORPORATION (US) 1996-05-30 — — WO claimed
US-6228878-B1 ADMINISTERING INDOLIN-5-ONE DERIVATIVES; INHIBITING FORMATION OF ABNORMALLY PHOSPHORYLATED PAIRED HELICAL FILAMENT EPITOPES MOLECULAR GERIATRICS CORPORATION 2001-05-08 — — US disclosed
US-5968936-A ADMINISTERING SUBSTITUTED 4,5,6,7-TETRAHYDRO-5-MORPHOLINOMETHYL-4-OXOINDOLES MOLECUALR GERIATRICS CORPORATION (US) 1999-10-19 — — US disclosed
US-5705501-A ADMINISTERING TO INHIBIT FORMATION OF ABNORMAL PHOSPHORYLATED PAIRED HELICAL FILAMENT EPITOPES MOLECULAR GERIATRICS CORPORATION (US) 1998-01-06 — — US disclosed
EP-0792151-A2 USE OF SUBSTITUTED ARYL-MORPHOLINO-, THIOMORPHOLINO- OR PIPERAZINO-PROPANONES FOR THE TREATEMENT OF PREVENTION OF ALZHEIMER'DISEASE MOLECULAR GERIATRICS CORPORATION (US) 1997-09-03 — — EP disclosed
WO-1996015791-A2 USE OF SUBSTITUTED ARYL-MORPHOLINO-, THIOMORPHOLINO- OR PIPERAZINO-PROPANONES FOR THE TREATEMENT OF PREVENTION OF ALZHEIMER'DISEASE MOLECULAR GERIATRICS CORPORATION (US) 1996-05-30 — — WO disclosed
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