Hydrochloric Acid

Hydrochloric Acid

SCHEMBL8916103

C=CCNC(=N)NC(=N)N.Cl

nearest known ligand 0.46

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 7)

geneUniProtsupporting neighboursconfidence
GAA known ✓ P10253 1/20 0.30
TSHR P16473 2/20 0.46
ALDH1A1 P00352 2/20 0.46
MAPT P10636 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KMT2A Q03164 1/20 0.32
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL245633 0.98 ALDH1A1 (0.48) TSHRALDH1A1MAPTSMN1; SMN2KMT2A
Hydrochloric Acid SCHEMBL2754173 0.81
SCHEMBL8215008 0.81 ALDH1A1 (0.45) TSHRALDH1A1MAPTSMN1; SMN2KMT2A
Guanidine SCHEMBL28281782 0.79 TSHR (0.52) TSHRALDH1A1MAPTSMN1; SMN2KMT2A
SCHEMBL37468 0.79
SCHEMBL5969554 0.78 TSHR (0.46) TSHRALDH1A1MAPTSMN1; SMN2KMT2A
SCHEMBL1506053 0.78 ALDH1A1 (0.48) TSHRALDH1A1MAPTSMN1; SMN2KMT2A
SCHEMBL30688875 0.77 ALDH1A1 (0.45) TSHRALDH1A1MAPTSMN1; SMN2KMT2A
SCHEMBL10658213 0.77 ALDH1A1 (0.56) TSHRALDH1A1MAPTSMN1; SMN2KMT2A
SCHEMBL7996738 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102241794-B Preparation method of reversible agglomeration and re-dispersion latex based on amidine compound UNIV ZHEJIANG 2012-12-19 CN claimed
CN-102492106-A Large molecular emulsifier with switchable surface activity and application thereof to preparation of rubber latex UNIV ZHEJIANG 2012-06-13 CN claimed
CN-102241794-A Preparation method of reversible agglomeration and re-dispersion latex based on amidine compound UNIV ZHEJIANG 2011-11-16 CN claimed
CN-101941675-A Nanoparticles and preparation method thereof XU WANG 2011-01-12 CN claimed
US-11572341-B2 Biguanide compound and use thereof IMMUNOMET THERAPEUTICS INC. (US) 2023-02-07 US disclosed
US-20200277255-A1 BIGUANIDE COMPOUND AND USE THEREOF IMMUNOMET THERAPEUTICS INC. 2020-09-03 US disclosed
US-9624317-B2 Amphiphilic macromolecular emulsifier with switchable surface activity and use thereof in preparation of polymer latex ZHEJIANG UNIVERSITY (CN) 2017-04-18 US disclosed
US-20140316049-A1 AMPHIPHILIC MACROMOLECULAR EMULSIFIER WITH SWITCHABLE SURFACE ACTIVITY AND USE THEREOF IN PREPARATION OF POLYMER LATEX ZHEJIANG UNIVERSITY (CN) 2014-10-23 US disclosed
CN-102241794-B Preparation method of reversible agglomeration and re-dispersion latex based on amidine compound UNIV ZHEJIANG 2012-12-19 CN disclosed
CN-102492106-A Large molecular emulsifier with switchable surface activity and application thereof to preparation of rubber latex UNIV ZHEJIANG 2012-06-13 CN disclosed
CN-102241794-A Preparation method of reversible agglomeration and re-dispersion latex based on amidine compound UNIV ZHEJIANG 2011-11-16 CN disclosed
CN-101941675-A Nanoparticles and preparation method thereof XU WANG 2011-01-12 CN disclosed
CN-1493601-A Aqueous emulsion type fluorine containing water repellent oil repellent agent and its preparation method 华东理工大学 2004-05-05 CN disclosed
US-5665843-A Allylbiguanide polymer and method of producing same DIRECTOR-GENERAL OF AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 1997-09-09 US disclosed
EP-0411153-B1 TRIAZINE DERIVATIVE AND HERBICIDE CONTAINING THE SAME AS ACTIVE INGREDIENT IDEMITSU KOSAN CO (JP) 1996-09-11 EP disclosed
US-5403815-A Combats weeds without casuing phytotoxicity to corn, barley, wheat or grains IDEMITSU KOSAN COMPANY LIMITED (JP) 1995-04-04 US disclosed
EP-0620220-A2 A triazine derivatives as herbicides IDEMITSU KOSAN COMPANY LIMITED (JP) 1994-10-19 EP disclosed
US-5290754-A Useful against weeds in rice crops IDEMITSU KOSAN COMPANY LIMITED (JP) 1994-03-01 US disclosed
EP-0411153-A1 TRIAZINE DERIVATIVE AND HERBICIDE CONTAINING THE SAME AS ACTIVE INGREDIENT IDEMITSU KOSAN COMPANY LIMITED (JP) 1991-02-06 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-11572341-B2 Biguanide compound and use thereof MKI67, GCG, GCKR GAA 788/4885TSHR 2521/4885ALDH1A1 1098/4885
US-20200277255-A1 BIGUANIDE COMPOUND AND USE THEREOF MKI67, GCG, GCKR GAA 788/4885TSHR 2521/4885ALDH1A1 1098/4885

“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.