Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7350625

Brc1ccc2c(C3CCNCC3)n[nH]c2c1.Cl

nearest known ligand 0.49

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
JAK2 known ✓ O60674 2/20 0.49
SLC6A4 known ✓ P31645 2/20 0.39
HTR2C known ✓ P28335 2/20 0.37
HTR2A known ✓ P28223 1/20 0.37
HTR2B known ✓ P41595 1/20 0.37
PRKD3 known ✓ O94806 1/20 0.35
CSF1R known ✓ P07333 1/20 0.35
FLT4 known ✓ P35916 1/20 0.35
FLT3 known ✓ P36888 1/20 0.35
NTRK3 known ✓ Q16288 1/20 0.35
PDPK1 O15530 2/20 0.49
AXL P30530 1/20 0.41
DYRK1A Q13627 5/20 0.40
CSNK2A1 P68400 2/20 0.37
CDC7 O00311 1/20 0.37
PIM1 P11309 1/20 0.37
CSNK2B P67870 1/20 0.37
GSK3B P49841 1/20 0.36
IDO1 P14902 1/20 0.35
MKNK2 Q9HBH9 3/20 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
SCHEMBL10395746 0.98 PDPK1 (0.50) PDPK1JAK2AXLDYRK1ASLC6A4
SCHEMBL29502056 0.89 PDPK1 (0.56) PDPK1JAK2AXLDYRK1ASLC6A4
SCHEMBL11977405 0.89 PDPK1 (0.56) PDPK1JAK2AXLDYRK1ASLC6A4
SCHEMBL14338763 0.87 PDPK1 (0.50) PDPK1JAK2AXLDYRK1ASLC6A4
SCHEMBL8469395 0.84 PDPK1 (0.50) PDPK1JAK2AXLDYRK1ASLC6A4
Hydrochloric Acid SCHEMBL7227155 0.82 HTR2A (0.46) SLC6A4HTR2CHTR2AMKNK2MKNK1
Hydrochloric Acid SCHEMBL8916894 0.82 HTR2A (0.46) SLC6A4HTR2CHTR2AMKNK2MKNK1
SCHEMBL29688637 0.81 HTR2A (0.47) SLC6A4HTR2CHTR2AMKNK2MKNK1
SCHEMBL1545411 0.81 HTR2A (0.47) SLC6A4HTR2CHTR2AMKNK2MKNK1
SCHEMBL9831569 0.81 MAPK1 (0.47) SLC6A4HTR2AGSK3B

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
CN-1222153-A Piperidine acetic acid derivatives and their use in the treatment of thrombotic disorders GLAXO GROUP LTD (GB) 1999-07-07 CN disclosed
EP-0799223-B1 PIPERIDINEACETIC ACID DERIVATIVES USEFUL AS FIBRINOGEN ANTAGONIST AGENT GLAXO GROUP LTD (GB) 1999-06-09 EP disclosed
EP-0912555-A1 PIPERIDINE ACETIC ACID DERIVATIVES AND THEIR USE IN THE TREATMENT OF THROMBOTIC DISORDERS GLAXO GROUP LIMITED (GB) 1999-05-06 EP disclosed
US-5861414-A INHIBITING BLOOD PLATELET AGGREGATION FOR ANTITHROMBOTIC DISORDERS GLAXO GROUP LIMITED (GB) 1999-01-19 US disclosed
CN-1175254-A Piperidineacetic acid derivatives useful as fibrinogen antagonist agent GLAXO GROUP LTD (GB) 1998-03-04 CN disclosed
WO-1997049699-A1 PIPERIDINE ACETIC ACID DERIVATIVES AND THEIR USE IN THE TREATMENT OF THROMBOTIC DISORDERS GLAXO GROUP LIMITED (GB) 1997-12-31 WO disclosed
WO-1997049698-A1 PIPERIDINE ACETIC ACID DERIVATIVES AND THEIR USE IN THE TREATMENT OF THROMBOTIC DISORDERS GLAXO GROUP LIMITED (GB) 1997-12-31 WO disclosed
EP-0799223-A1 PIPERIDINEACETIC ACID DERIVATIVES USEFUL AS FIBRINOGEN ANTAGONIST AGENT GLAXO GROUP LIMITED (GB) 1997-10-08 EP disclosed
WO-1996020192-A1 PIPERIDINEACETIC ACID DERIVATIVES USEFUL AS FIBRINOGEN ANTAGONIST AGENT GLAXO GROUP LIMITED (GB) 1996-07-04 WO disclosed