Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4846464

CCN(c1cccs1)C(C(=O)O)c1ccccc1Cl.Cl

nearest known ligand 0.45

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 15)

geneUniProtsupporting neighboursconfidence
OPRM1 known ✓ P35372 3/20 0.45
CXCL8 P10145 1/20 0.35
RORC P51449 1/20 0.35
TP53 P04637 1/20 0.35
CASP1 P29466 1/20 0.34
TRPM8 Q7Z2W7 1/20 0.34
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 1/20 0.34
AOC3 Q16853 1/20 0.33
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CYP2C19 P33261 1/20 0.33
MC4R P32245 1/20 0.33

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
SCHEMBL8020175 0.99 OPRM1 (0.46) OPRM1CXCL8RORCTP53CASP1
SCHEMBL7055718 0.99 OPRM1 (0.46) OPRM1CXCL8RORCTP53CASP1
Hydrochloric Acid SCHEMBL28361730 0.87 OPRM1 (0.42) OPRM1RORCCASP1NR1H2NR1H3
Hydrochloric Acid SCHEMBL1159843 0.87 OPRM1 (0.42) OPRM1RORCCASP1NR1H2NR1H3
Hydrochloric Acid SCHEMBL1159973 0.87 OPRM1 (0.42) OPRM1RORCCASP1NR1H2NR1H3
SCHEMBL1160304 0.85 OPRM1 (0.43) OPRM1RORCCASP1NR1H2NR1H3
SCHEMBL1417521 0.85 OPRM1 (0.43) OPRM1RORCCASP1NR1H2NR1H3
Hydrochloric Acid SCHEMBL28361713 0.83 OPRM1 (0.48) OPRM1TRPM8
Hydrochloric Acid SCHEMBL1419666 0.82 OPRM1 (0.37) OPRM1RORCCASP1TRPM8ALDH1A1
SCHEMBL1609792 0.82 OPRM1 (0.38) OPRM1RORCTP53CASP1TRPM8

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-103435631-B The preparation method of I-type clopidogrel hydrogen sulfate SICHUAN EMEISHAN PHARMACEUTICAL CO., LTD. (CN) 2015-08-26 CN claimed
CN-110776519-B Preparation method of clopidogrel hydrogen sulfate crystal form II 湖南迪诺制药股份有限公司 2020-05-26 CN disclosed
CN-110776519-A Preparation method of clopidogrel hydrogen sulfate crystal form II 湖南迪诺制药股份有限公司 2020-02-11 CN disclosed
CN-103435631-B The preparation method of I-type clopidogrel hydrogen sulfate SICHUAN EMEISHAN PHARMACEUTICAL CO., LTD. (CN) 2015-08-26 CN disclosed
CN-103435631-B The preparation method of I-type clopidogrel hydrogen sulfate SICHUAN EMEISHAN PHARMACEUTICAL CO., LTD. (CN) 2015-08-26 CN disclosed
US-7446200-B2 Rapid resolution process of clopidogrel base and a process for preparation of clopidogrel bisulfate polymorph-form I USV, LTD. (IN) 2008-11-04 US disclosed
US-20070191609-A1 PROCESS FOR PREPARATION OF CLOPIDOGREL BISULPHATE FORM-1 LEE PHARMA LIMITED (IN) 2007-08-16 US disclosed
US-20060074242-A1 Rapid resolution process of clopidogrel base and a process for preparation of clopidogrel bisulfate polymorph-form I USV LIMITED (IN) 2006-04-06 US disclosed
US-6080875-A REACTING A THIENYLGLYCIDIC DERIVATIVE WITH A PHENYLGLYCINE ESTER IN THE PRESENCE OF AN ALKALI METAL BOROHYDRIDE, DECYCLIZATION; PREPARING DRUGS FOR TREATING ANTI-PLATELET AGGREGATION AND ANTITHROMBOTIC ACTIVITIES SANOFI-SYNTHELABO (FR) 2000-06-27 US 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 (2 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-20060074242-A1 Rapid resolution process of clopidogrel base and a process for preparation of clopidogrel bisulfate polymorph-form I SRR, P2RY11, CYP2C19 OPRM1 1422/4885CXCL8 3535/4885RORC 995/4885
US-20070191609-A1 PROCESS FOR PREPARATION OF CLOPIDOGREL BISULPHATE FORM-1 SULT1A1, SF1, ADH1C OPRM1 1805/4885CXCL8 2583/4885RORC 4194/4885

“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.