Hydrochloric Acid

Hydrochloric Acid

SCHEMBL857460

Cl.N=C(N)c1ccccn1

nearest known ligand 0.59

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
ADRA2A known ✓ P08913 2/20 0.45
ADRA2B known ✓ P18089 2/20 0.45
ADRA2C known ✓ P18825 2/20 0.45
HDAC3 known ✓ O15379 1/20 0.42
HDAC4 known ✓ P56524 1/20 0.42
HDAC1 known ✓ Q13547 1/20 0.42
HDAC7 known ✓ Q8WUI4 1/20 0.42
HDAC2 known ✓ Q92769 1/20 0.42
HDAC10 known ✓ Q969S8 1/20 0.42
HDAC11 known ✓ Q96DB2 1/20 0.42
HDAC8 known ✓ Q9BY41 1/20 0.42
HDAC6 known ✓ Q9UBN7 1/20 0.42
HDAC9 known ✓ Q9UKV0 1/20 0.42
HDAC5 known ✓ Q9UQL6 1/20 0.42
GAA known ✓ P10253 1/20 0.41
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
LMNA P02545 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
NAPRT Q6XQN6 1/20 0.50

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 SCHEMBL29535473 1.00 CES2 (0.52) CES2CES1LMNAL3MBTL1NAPRT
Hydrochloric Acid SCHEMBL5945629 0.98 CES2 (0.50) CES2CES1LMNAL3MBTL1NAPRT
SCHEMBL247847 0.98
Water SCHEMBL27552684 0.95 CES2 (0.52) CES2CES1LMNAL3MBTL1NAPRT
Pyridine SCHEMBL30058515 0.90 LMNA (0.50) CES2CES1LMNAL3MBTL1NAPRT
Pyrrole SCHEMBL28132369 0.86 CES2 (0.44) CES2CES1LMNAL3MBTL1NAPRT
Acetic Acid SCHEMBL27680883 0.86 ALDH1A1 (0.60) CES2CES1LMNAL3MBTL1NAPRT
Hydrochloric Acid SCHEMBL8545563 0.84 GRM5 (0.43) CES2CES1LMNAL3MBTL1NAPRT
Ether SCHEMBL9739851 0.83 ADRA2A (0.44) CES2CES1LMNAL3MBTL1NAPRT
Maleic Acid SCHEMBL7226173 0.83 LMNA (0.53) CES2CES1LMNAL3MBTL1NAPRT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119156093-A Perovskite solar cell and preparation method thereof 深圳职业技术大学 2024-12-17 CN claimed
CN-117998878-A Passivation layer modified trans-perovskite solar cell and preparation method thereof 深圳市曼恩斯特科技股份有限公司 2024-05-07 CN claimed
EP-3556803-B1 CURING AGENTS FOR COMPOUNDS DUPONT POLYMERS INC (US) 2023-10-04 EP claimed
CN-113024470-B 4-perfluoroalkyl substituted pyrimidine compound and preparation method and application thereof 南京工业大学 2022-05-24 CN claimed
EP-3558964-B1 4-AMINO-2-PYRIDO-BICYCLIC PYRIMIDINES AND USE THEREOF AS TOPOISOMERASE II INHIBITORS FONDAZIONE ST ITALIANO TECNOLOGIA (IT) 2022-05-04 EP claimed
US-11274189-B2 Curing agents for compounds DUPONT POLYMERS, INC. (US) 2022-03-15 US claimed
CN-113024470-A 4-perfluoroalkyl substituted pyrimidine compound and preparation method and application thereof 南京工业大学 2021-06-25 CN claimed
CN-110368782-A A method of ammonia is efficiently trapped using H-bonding self-assembly type ionic liquid 华侨大学 2019-10-25 CN claimed
EP-3556803-A1 CURING AGENTS FOR COMPOUNDS E. I. du Pont de Nemours and Company (US) 2019-10-23 EP claimed
US-20190315709-A1 4-AMINO-2-PYRIDO-BICYCLIC PYRIMIDINES AND USE THEREOF AS TOPOISOMERASE II INHIBITORS FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2019-10-17 US claimed
EP-3205690-A1 CURING AGENTS FOR FLUOROELASTOMERS E. I. du Pont de Nemours and Company (US) 2017-08-16 EP claimed
US-20170088693-A1 Curing Agents For Fluoroelastomers DUPONT SPECIALTY PRODUCTS USA, LLC 2017-03-30 US claimed
US-20170088692-A1 CURING AGENTS FOR COMPOUNDS E I DU PONT DE NEMOURS AND COMPANY (US) 2017-03-30 US claimed
CN-106397433-A 2-(2-pyridine)-6-(2-chloro-3-trifluoromethylbenzoyl)-5,7,8-trihydropyrido [4,3-d] pyrimidine and preparation method thereof 广东环境保护工程职业学院 2017-02-15 CN claimed
CN-105669672-A Pyridopyrimidine compounds and preparation method thereof 广东环境保护工程职业学院 2016-06-15 CN claimed
EP-0670836-B1 PYRIDYL-1,2,4-THIADIAZOLES AS PEST-CONTROL AGENTS BAYER AG (DE) 2001-10-04 EP claimed
EP-0557860-B1 Substituted pyridiylpyrimidines and their use as parasiticide BAYER AG (DE) 2001-01-10 EP claimed
EP-0670836-A1 PYRIDYL-1,2,4-THIADIAZOLES AS PEST-CONTROL AGENTS BAYER AG (DE) 1995-09-13 EP claimed
WO-1994012496-A1 PYRIDYL-1,2,4-THIADIAZOLES AS PEST-CONTROL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 1994-06-09 WO claimed
EP-0557860-A1 Substituted pyridiylpyrimidines and their use as parasiticide BAYER AG (DE) 1993-09-01 EP claimed

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-20190315709-A1 4-AMINO-2-PYRIDO-BICYCLIC PYRIMIDINES AND USE THEREOF AS TOPOISOMERASE II INHIBITORS TYMP, TOP2A, TOP2B ADRA2A 2221/4885ADRA2B 1860/4885ADRA2C 1356/4885

“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.