Hydrochloric Acid

Hydrochloric Acid

SCHEMBL1134854

CN(c1ccccc1)c1ccc(Cl)cc1.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
CSF1R known ✓ P07333 1/20 0.45
S1PR4 known ✓ O95977 1/20 0.42
HSP90AA1 known ✓ P07900 1/20 0.42
S1PR1 known ✓ P21453 1/20 0.42
GSK3B P49841 1/20 0.49
CES1 P23141 1/20 0.47
CHKA P35790 8/20 0.47
TSHR P16473 2/20 0.46
NR3C2 P08235 1/20 0.46
CYP1A2 P05177 1/20 0.44
LMNA P02545 3/20 0.42
HPGD P15428 3/20 0.42
ALOX15 P16050 2/20 0.42
MAPT P10636 1/20 0.42
ALDH1A1 P00352 3/20 0.42
MEN1 O00255 1/20 0.42
MAPK1 P28482 1/20 0.42
CCR6 P51684 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL1134844 0.98 GSK3B (0.50) GSK3BCES1CHKATSHRNR3C2
Hydrochloric Acid SCHEMBL6414496 0.90 CHKA (0.53) CES1CHKATSHRCSF1RLMNA
SCHEMBL5213200 0.87 CHKA (0.55) CES1CHKATSHRLMNAHPGD
Ethane SCHEMBL6986774 0.85 CHKA (0.53) CES1CHKATSHRLMNAHPGD
SCHEMBL7155149 0.84 NR3C2 (0.56) GSK3BCES1CHKATSHRNR3C2
Hydrochloric Acid SCHEMBL10871690 0.84 CHKA (0.50) GSK3BCES1CHKANR3C2LMNA
Hydrochloric Acid SCHEMBL1764754 0.84 CHKA (0.50) GSK3BCES1CHKANR3C2LMNA
SCHEMBL22931682 0.82 MEN1 (0.52) GSK3BCES1CHKANR3C2LMNA
SCHEMBL20385081 0.82 MEN1 (0.52) GSK3BCES1CHKANR3C2LMNA
SCHEMBL31886 0.82 MEN1 (0.52) GSK3BCES1CHKANR3C2LMNA

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-102675017-A Method for preparing chiral diaryl- substitute methylamine HEBEI BRANT PHARMACEUTICAL CO LTD 2012-09-19 CN disclosed
US-20110251389-A1 Process For Making N-(Diphenylmethyl)piperazines ZHU JIE 2011-10-13 US disclosed
US-7989623-B2 Process for making n-(diphenylmethyl)piperazines SYNTHON BV (NL) 2011-08-02 US disclosed
EP-2062881-B1 Process for making N-(diphenylmethyl)piperazines SYNTHON BV (NL) 2011-02-23 EP disclosed
US-20100145049-A1 PROCESS FOR MAKING N-(DIPHENYLMETHYL)PIPERAZINES SYNTHON BV (NL) 2010-06-10 US disclosed
WO-2010057515-A1 LEVOCETIRIZINE BY MENTHYL INTERMEDIATE SYNTHON B.V. (NL) 2010-05-27 WO disclosed
US-20090143582-A1 Process for making n-(diphenylmethyl)piperazines SYNTHON BV (NL) 2009-06-04 US disclosed
WO-2009065622-A1 PROCESS FOR MAKING N-(DIPHENYLMETHYL)PIPERAZINES SYNTHON B.V. (NL) 2009-05-28 WO disclosed
EP-2062881-A1 Process for making N-(diphenylmethyl)piperazines Synthon B.V. (NL) 2009-05-27 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110251389-A1 Process For Making N-(Diphenylmethyl)piperazines CYP51A1, CYP3A5, CYP4Z1 CSF1R 1466/4885S1PR4 570/4885HSP90AA1 4771/4885
US-20100145049-A1 PROCESS FOR MAKING N-(DIPHENYLMETHYL)PIPERAZINES IL5, PRMT5, IL15 CSF1R 473/4885S1PR4 535/4885HSP90AA1 4492/4885
US-20090143582-A1 Process for making n-(diphenylmethyl)piperazines CYP51A1, CYP3A5, CYP4Z1 CSF1R 1466/4885S1PR4 570/4885HSP90AA1 4771/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.