Hydrochloric Acid

Hydrochloric Acid

SCHEMBL11278622

Cl.Nc1nc(CC(=O)Cl)cs1

nearest known ligand 0.68

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
GABRA5 known ✓ P31644 1/20 0.68
GABRB2 known ✓ P47870 1/20 0.68
GAA known ✓ P10253 1/20 0.38
HSD17B10 Q99714 1/20 0.68
RAB9A P51151 5/20 0.42
NPC1 O15118 4/20 0.42
MAPT P10636 3/20 0.42
ALDH1A1 P00352 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
NOS1 P29475 1/20 0.42
AOC3 Q16853 1/20 0.41
SMN1; SMN2 Q16637 6/20 0.40
ATM Q13315 1/20 0.38
KDM4E B2RXH2 1/20 0.38

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
SCHEMBL17492250 0.98 GABRA5 (0.70) GABRA5GABRB2HSD17B10RAB9ANPC1
Hydrochloric Acid SCHEMBL9694699 0.83 GABRA5 (0.96) GABRA5GABRB2HSD17B10RAB9ANPC1
SCHEMBL909845 0.81 HSD17B10 (1.00) GABRA5GABRB2HSD17B10RAB9ANPC1
SCHEMBL1797901 0.81 GABRA5 (0.72) GABRA5GABRB2HSD17B10RAB9ANPC1
SCHEMBL9864403 0.79 HSD17B10 (0.96) GABRA5GABRB2HSD17B10RAB9ANPC1
SCHEMBL3736516 0.79 GABRA5 (0.70) GABRA5GABRB2HSD17B10RAB9ANPC1
SCHEMBL11926737 0.79 HSD17B10 (0.70) GABRA5GABRB2HSD17B10RAB9ANPC1
Hydrochloric Acid SCHEMBL27348777 0.79 GABRA5 (0.55) GABRA5GABRB2HSD17B10RAB9ANPC1
Methyl Alcohol SCHEMBL10946415 0.78 HSD17B10 (0.93) GABRA5GABRB2HSD17B10RAB9ANPC1
SCHEMBL27820689 0.78 GABRA5 (0.68) GABRA5GABRB2HSD17B10RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101648961-B Method and equipment for preparing cefotiam hydrochloride HARBIN PHARMACEUTICAL GROUP CO LTD GENERAL PHARMACEUTICAL FACTORY 2011-06-29 CN claimed
CN-105017173-A Cefotiam impurity A derivative preparation method GUANGZHOU BAIYUNSHAN TIANXIN PHARMACEUTICAL CO LTD 2015-11-04 CN disclosed
CN-1824658-B Improvement preparation method of using 2-aminothiazole-4-acetyl chloride hydrochloride as intermediate of preparation cephalosporin HAN MI PHARM IND CO LTD 2011-10-05 CN disclosed
CN-1824658-B Improvement preparation method of using 2-aminothiazole-4-acetyl chloride hydrochloride as intermediate of preparation cephalosporin HAN MI PHARM IND CO LTD 2011-10-05 CN disclosed
CN-1824658-A Improvement preparation method of using 2-aminothiazole-4-acetyl chloride hydrochloride as intermediate of preparation cephalosporin HAN MI PHARM IND CO LTD (KR) 2006-08-30 CN disclosed
CN-1824658-A Improvement preparation method of using 2-aminothiazole-4-acetyl chloride hydrochloride as intermediate of preparation cephalosporin HAN MI PHARM IND CO LTD (KR) 2006-08-30 CN disclosed
US-4324892-A 7-(N-Substituted-2-phenylglycinamido)-3-substituted-3-cephem-4-carboxylic acid compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-04-13 US disclosed
US-4172198-A ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1979-10-23 US disclosed