Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3298280

CCN=C=NCCCN(C)C.CCN=C=NCCCN(C)C.Cl

nearest known ligand 0.96

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 10)

geneUniProtsupporting neighboursconfidence
HRH2 known ✓ P25021 1/20 0.32
CYP1A2 P05177 2/20 0.96
CYP2D6 P10635 1/20 0.96
DNM1 Q05193 3/20 0.39
ALDH1A1 P00352 3/20 0.36
TSHR P16473 1/20 0.36
HRH4 Q9H3N8 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 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
Hydrochloric Acid SCHEMBL1595766 1.00 CYP1A2 (0.96) CYP1A2CYP2D6DNM1ALDH1A1TSHR
Hydrochloric Acid SCHEMBL2761 1.00 CYP1A2 (0.96) CYP1A2CYP2D6DNM1ALDH1A1TSHR
Hydrochloric Acid SCHEMBL28259087 0.98 CYP1A2 (0.92) CYP1A2CYP2D6DNM1ALDH1A1TSHR
Hydrochloric Acid SCHEMBL29244052 0.98 CYP1A2 (0.92) CYP1A2CYP2D6DNM1ALDH1A1TSHR
Hydrochloric Acid SCHEMBL28055589 0.98 CYP1A2 (0.92) CYP1A2CYP2D6DNM1ALDH1A1TSHR
Ethane SCHEMBL23167555 0.98 CYP1A2 (0.92) CYP1A2CYP2D6DNM1ALDH1A1TSHR
Hydrochloric Acid SCHEMBL31470480 0.98 CYP1A2 (0.92) CYP1A2CYP2D6DNM1ALDH1A1TSHR
Hydrochloric Acid SCHEMBL4449367 0.98 CYP1A2 (0.92) CYP1A2CYP2D6DNM1ALDH1A1TSHR
Hydrochloric Acid SCHEMBL21402151 0.98 CYP1A2 (0.92) CYP1A2CYP2D6DNM1ALDH1A1TSHR
Hydrochloric Acid SCHEMBL27646828 0.98 CYP1A2 (0.92) CYP1A2CYP2D6DNM1ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118311023-A Method for detecting novel crown antigen by near-infrared luminophor ultrasensitive full-automatic chemiluminescence method 山东大学 2024-07-09 CN disclosed
CN-118209744-A Ultrasensitive procalcitonin antigen detection method for improving stability of luminophor based on auxiliary material method 山东大学 2024-06-18 CN disclosed
CN-116270850-B Wuzi Yanzong oral liquid and preparation method thereof 江西大自然制药有限公司 2024-06-04 CN disclosed
CN-115248308-B Application of poly-L-dopa nano-particles in preparation of immunochromatography detection test strip 浙江大学 2024-05-31 CN disclosed
CN-114965638-B Ratio type biosensor with internal reference signal and preparation method 南京邮电大学 2024-05-24 CN disclosed
CN-114410764-B Preparation method of long DNA sequence silica microbeads 北京百迈客生物科技有限公司 2024-05-10 CN disclosed
CN-117771437-A Polyelectrolyte uniform modified intra-fiber mineralized stent material and preparation method and application thereof 四川大学 2024-03-29 CN disclosed
CN-114377210-B Polyurethane/small intestine submucosa/polypyrrole composite material and preparation method and application thereof 四川大学华西医院 2024-02-20 CN disclosed
CN-117089599-B Long coding sequence microbead and preparation method thereof 青岛百创智能制造技术有限公司 2024-02-13 CN disclosed
CN-117434259-A Method for coupling magnetic beads and antibodies based on carbodiimide method 上海思路迪生物医学科技有限公司 2024-01-23 CN disclosed
CN-106009082-A Coating rubber material of environment-friendly printing rubber roll and preparation method of coating rubber material 铜陵宏正网络科技有限公司 2016-10-12 CN disclosed
CN-106009086-A Coating rubber material of rosin-tackified printing rubber roller and preparation method of coating rubber material 铜陵宏正网络科技有限公司 2016-10-12 CN disclosed
CN-106009083-A Coating rubber material of aerogel printing rubber roll and preparation method of coating rubber material 铜陵宏正网络科技有限公司 2016-10-12 CN disclosed
CN-106009080-A Coating rubber material of fireproof printing rubber roller and preparation method of coating rubber material 铜陵宏正网络科技有限公司 2016-10-12 CN disclosed
CN-106009079-A Coating rubber material for composite fiber modified printing rubber roll and preparation method of coating rubber material 铜陵宏正网络科技有限公司 2016-10-12 CN disclosed
CN-105968444-A Coating rubber material for toughened printing rubber rolls and preparation method of coating rubber material 铜陵宏正网络科技有限公司 2016-09-28 CN disclosed
US-7737166-B2 Antifungal bicyclic hetero ring compounds DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-06-15 US disclosed
US-20090143353-A1 such as 2-tert-Butyl-7-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-5-methyl-6-phenyl-1,3-benzoxazole-4-carbonitrile hydrochloride, a 1,6-beta-glucan synthetase inhibitor having potent growth inhibition, used treating a fungal infections; fungicides DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-06-04 US disclosed
EP-1932837-A1 BICYCLO HETEROCYCLIC COMPOUND HAVING ANTIFUNGAL ACTION Daiichi Sankyo Company, Limited (JP) 2008-06-18 EP disclosed
US-RE37686-E1 Azahydroxybenzotriazoles and derivatives thereof for peptide coupling reactions RESEARCH CORPORATION TECHNOLOGIES, INC. 2002-04-30 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 (1 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-20090143353-A1 such as 2-tert-Butyl-7-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-5-methyl-6-phenyl-1,3-benzoxazole-4-carbonitrile hydrochloride, a 1,6-beta-glucan synthetase inhibitor having potent growth inhibition, used treating a fungal infections; fungicides CTPS1, TPP1, STS HRH2 4005/4885CYP1A2 605/4885CYP2D6 1064/4885

“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.