Hydrochloric Acid

Hydrochloric Acid

SCHEMBL446333

Cl.Cl.NNc1cccnc1

nearest known ligand 0.50

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
PTGS2 known ✓ P35354 1/20 0.46
ADRA2A known ✓ P08913 2/20 0.46
ADRA2B known ✓ P18089 2/20 0.46
ADRA2C known ✓ P18825 2/20 0.46
GAA known ✓ P10253 1/20 0.44
PRKCI known ✓ P41743 1/20 0.42
RAB9A P51151 2/20 0.47
NPC1 O15118 1/20 0.47
PKM P14618 1/20 0.47
CFTR P13569 1/20 0.47
GOPC Q9HD26 1/20 0.47
LMNA P02545 2/20 0.46
CYP1A2 P05177 2/20 0.46
CYP3A4 P08684 2/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
IDO1 P14902 1/20 0.46
CYP2C19 P33261 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
HIF1A Q16665 1/20 0.46

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 SCHEMBL1013660 1.00
Hydrochloric Acid SCHEMBL25246100 1.00
SCHEMBL1013700 0.98
Cyanide SCHEMBL28084860 0.91 GAA (0.46) RAB9ANPC1PKMCFTRGOPC
Propane SCHEMBL10608405 0.89 RAB9A (0.47) RAB9ANPC1PKMCFTRGOPC
Formic Acid SCHEMBL27671745 0.86 RAB9A (0.49) RAB9ANPC1PKMLMNAHIF1A
Acrylonitrile SCHEMBL28122959 0.84 GAA (0.49) RAB9ANPC1PKMCFTRGOPC
SCHEMBL16322245 0.81 ATG4B (0.46) RAB9ANPC1PKMCFTRGOPC
SCHEMBL9551726 0.79
SCHEMBL29793056 0.77 KIF11 (0.60) RAB9ANPC1PKMCFTRGOPC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105636441-B The method for preparing Pesticidal compound 美国陶氏益农公司 2018-06-15 CN claimed
US-20180099945-A1 PROCESSES FOR THE PREPARATION OF PESTICIDAL COMPOUNDS DOW AGROSCIENCES LLC (US) 2018-04-12 US claimed
US-20180044319-A1 PROCESSES FOR THE PREPARATION OF PESTICIDAL COMPOUNDS DOW AGROSCIENCES LLC (US) 2018-02-15 US claimed
CN-107074775-A The preparation method of 3 (base of 3 chlorine 1H pyrazoles 1) pyridines 美国陶氏益农公司 2017-08-18 CN claimed
CN-107074774-A The method for preparing 3 (base of 3 chlorine 1H pyrazoles 1) pyridines 美国陶氏益农公司 2017-08-18 CN claimed
US-20170226078-A1 PROCESSES FOR THE PREPARATION OF PESTICIDAL COMPOUNDS DOW AGROSCIENCES LLC (US) 2017-08-10 US claimed
EP-3191455-A1 PROCESS FOR THE PREPARATION OF 3-(3-CHLORO-1H-PYRAZOL-1-YL)PYRIDINE Dow AgroSciences LLC (US) 2017-07-19 EP claimed
EP-3186230-A1 PROCESS FOR THE PREPARATION OF 3-(3-CHLORO-1H-PYRAZOL-1-YL)PYRIDINE Dow AgroSciences, LLC (US) 2017-07-05 EP claimed
EP-3183238-A1 PROCESS FOR THE PREPARATION OF 3-(3-CHLORO-1H-PYRAZOL-1-YL)PYRIDINE Dow AgroSciences LLC (US) 2017-06-28 EP claimed
EP-3174856-A1 PROCESS FOR THE PREPARATION OF 3-(3-CHLORO-1H-PYRAZOL-1-YL)PYRIDINE Dow AgroSciences LLC (US) 2017-06-07 EP claimed
US-9115115-B1 Process for the preparation of 3-(3-chloro-1H-pyrazol-1-yl)pyridine DOW AGROSCIENCES LLC (US) 2015-08-25 US claimed
US-9108946-B2 Processes for the preparation of pesticidal compounds DOW AGROSCIENCES LLC (US) 2015-08-18 US claimed
US-9102654-B2 Processes for the preparation of pesticidal compounds DOW AGROSCIENCES LLC (US) 2015-08-11 US claimed
US-9085552-B1 Process for the preparation of 3-(3-chloro-1H-pyrazol-1-yl)pyridine DOW AGROSCIENCES LLC (US) 2015-07-21 US claimed
US-9029555-B1 Process for the preparation of 3-(3-chloro-1H-pyrazol-1-yl)pyridine DOW AGROSCIENCES LLC (US) 2015-05-12 US claimed
US-9024031-B1 Process for the preparation of 3-(3-chloro-1H-pyrazol-1-yl)pyridine DOW AGROSCIENCES LLC (US) 2015-05-05 US claimed
WO-2015058028-A1 PROCESSES FOR THE PREPARATION OF PESTICIDAL COMPOUNDS DOW AGROSCIENCES LLC (US) 2015-04-23 WO claimed
WO-2015058021-A1 PROCESSES FOR THE PREPARATION OF PESTICIDAL COMPOUNDS DOW AGROSCIENCES LLC (US) 2015-04-23 WO claimed
US-20150112078-A1 PROCESSES FOR THE PREPARATION OF PESTICIDAL COMPOUNDS DOW AGROSCIENCES LLC 2015-04-23 US claimed
US-20150112077-A1 PROCESSES FOR THE PREPARATION OF PESTICIDAL COMPOUNDS DOW AGROSCIENCES LLC 2015-04-23 US 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 (5 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-20150112078-A1 PROCESSES FOR THE PREPARATION OF PESTICIDAL COMPOUNDS DDT, ACHE, PTMS PTGS2 973/4885ADRA2A 2400/4885ADRA2B 2402/4885
US-20180044319-A1 PROCESSES FOR THE PREPARATION OF PESTICIDAL COMPOUNDS DDT, ACHE, PTMS PTGS2 973/4885ADRA2A 2400/4885ADRA2B 2402/4885
US-20170226078-A1 PROCESSES FOR THE PREPARATION OF PESTICIDAL COMPOUNDS DDT, ACHE, PTMS PTGS2 973/4885ADRA2A 2400/4885ADRA2B 2402/4885
US-20180099945-A1 PROCESSES FOR THE PREPARATION OF PESTICIDAL COMPOUNDS DDT, ACHE, PTMS PTGS2 973/4885ADRA2A 2400/4885ADRA2B 2402/4885
US-20150112077-A1 PROCESSES FOR THE PREPARATION OF PESTICIDAL COMPOUNDS DDT, ACHE, PTMS PTGS2 973/4885ADRA2A 2400/4885ADRA2B 2402/4885

“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.