Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3135041

CO/N=C(\C(=O)Cl)c1csc(N)n1.Cl

nearest known ligand 0.60

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
GAA known ✓ P10253 1/20 0.47
PTGS2 known ✓ P35354 1/20 0.44
HTR2C known ✓ P28335 1/20 0.41
PPARG known ✓ P37231 1/20 0.39
PTGS1 known ✓ P23219 1/20 0.39
ESR1 known ✓ P03372 1/20 0.37
DRD2 known ✓ P14416 1/20 0.37
ADRA2B known ✓ P18089 1/20 0.37
HRH3 known ✓ Q9Y5N1 1/20 0.37
MAPT P10636 6/20 0.49
ALDH1A1 P00352 3/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
LMNA P02545 3/20 0.47
NR1I2 O75469 4/20 0.44
PGR P06401 1/20 0.44
ITGB1 P05556 2/20 0.43
ITGA4 P13612 2/20 0.43

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
Hydrochloric Acid SCHEMBL3135045 1.00 MAPT (0.49) MAPTALDH1A1MEN1KMT2ANPC1
Hydrochloric Acid SCHEMBL5340165 1.00 MAPT (0.49) MAPTALDH1A1MEN1KMT2ANPC1
SCHEMBL7027843 0.98 MAPT (0.48) MAPTALDH1A1MEN1KMT2ANPC1
SCHEMBL8895090 0.98 MAPT (0.48) MAPTALDH1A1MEN1KMT2ANPC1
SCHEMBL8872097 0.98 MAPT (0.48) MAPTALDH1A1MEN1KMT2ANPC1
Hydrochloric Acid SCHEMBL7020610 0.87 MAPT (0.58) MAPTALDH1A1MEN1KMT2ANPC1
Hydrochloric Acid SCHEMBL3135048 0.87 MAPT (0.58) MAPTALDH1A1MEN1KMT2ANPC1
Hydrochloric Acid SCHEMBL6133351 0.86 MAPT (0.47) MAPTALDH1A1MEN1KMT2ANPC1
Hydrochloric Acid SCHEMBL1405847 0.86 MAPT (0.47) MAPTALDH1A1MEN1KMT2ANPC1
Hydrochloric Acid SCHEMBL1405849 0.86 MAPT (0.47) MAPTALDH1A1MEN1KMT2ANPC1

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5194531-A None JP disclosed
US-7847093-B2 Processes for the preparations of cefepime SANDOZ AG (CH) 2010-12-07 US disclosed
EP-2218723-A2 Processes for the preparations of cefepime Sandoz AG (CH) 2010-08-18 EP disclosed
EP-1618114-B1 PROCESSES FOR THE PREPARATIONS OF CEFEPIME SANDOZ AG (CH) 2010-07-14 EP disclosed
US-20070105830-A1 Processes for the preparations of cefepime SANDOZ AG (CH) 2007-05-10 US disclosed
EP-1618114-A2 PROCESSES FOR THE PREPARATIONS OF CEFEPIME Sandoz AG (CH) 2006-01-25 EP disclosed
US-20050043531-A1 Process for preparing cefepime HANDA VIJAY KUMAR (IN) 2005-02-24 US disclosed
WO-2004092183-A2 PROCESSES FOR THE PREPARATIONS OF CEFEPIME SANDOZ AG (CH) 2004-10-28 WO disclosed
EP-0533047-B1 Preparation of a cephalosporin antibiotic using the synisomer of a thiazolyl intermediate BRISTOL MYERS SQUIBB CO (US) 2003-05-07 EP disclosed
EP-0531981-B1 Process for the preparation of a cephalosporin antibiotic BRISTOL MYERS SQUIBB CO (US) 2001-11-21 EP disclosed
EP-0675116-A1 Protected aminothiazolylacetic acid derivatives EISAI CHEMICAL CO., LTD. (JP) 1995-10-04 EP disclosed
EP-0665847-A1 CEPHEM COMPOUNDS, AND THEIR PHARMACEUTICAL COMPOSITIONS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-08-09 EP disclosed
WO-1994010177-A1 CEPHEM COMPOUNDS, AND THEIR PHARMACEUTICAL COMPOSITIONS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-05-11 WO disclosed
WO-1994007898-A1 NOVEL CEPHALOSPORIN DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 1994-04-14 WO disclosed
US-5302712-A Intermediates for cephem compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-04-12 US disclosed
JP-H05194531-A PRODUCTION OF CEPHALOSPORIN ANTIBIOTIC USING SYN-ISOMER OF THIAZOLYL INTERMEDIATE BRISTOL MYERS SQUIBB CO 1993-08-03 JP disclosed
US-5215982-A Antibiotics FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-06-01 US disclosed
EP-0533047-A1 Preparation of a cephalosporin antibiotic using the synisomer of a thiazolyl intermediate Bristol-Myers Squibb Company (US) 1993-03-24 EP disclosed
EP-0531981-A1 Process for the preparation of a cephalosporin antibiotic Bristol-Myers Squibb Company (US) 1993-03-17 EP disclosed
EP-0427248-A2 New cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-05-15 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 (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-20070105830-A1 Processes for the preparations of cefepime CYP3A5, CYP2F1, CYP2C9 GAA 1891/4885PTGS2 1566/4885HTR2C 3121/4885
US-20050043531-A1 Process for preparing cefepime CPNE4, MRPL21, OTUB1 GAA 2667/4885PTGS2 2219/4885HTR2C 2200/4885

“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.