Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3737085

CN(C)[P+](On1nnc2ccccc21)(N(C)C)N(C)C.[Cl-]

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

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
SLC9A1 P19634 3/20 0.49
KEAP1 Q14145 1/20 0.49
TSHR P16473 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
RXFP1 Q9HBX9 1/20 0.47
KMT2A Q03164 5/20 0.42
HDAC3 O15379 3/20 0.42
HDAC4 P56524 3/20 0.42
HDAC1 Q13547 3/20 0.42
HDAC7 Q8WUI4 3/20 0.42
HDAC2 Q92769 3/20 0.42
HDAC10 Q969S8 3/20 0.42
HDAC11 Q96DB2 3/20 0.42
HDAC8 Q9BY41 3/20 0.42
HDAC6 Q9UBN7 3/20 0.42
HDAC9 Q9UKV0 3/20 0.42
HDAC5 Q9UQL6 3/20 0.42
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
POLB P06746 1/20 0.41

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 SCHEMBL30591144 1.00 SLC9A1 (0.49) SLC9A1KEAP1TSHRNPSR1RXFP1
SCHEMBL29399678 0.98 SLC9A1 (0.50) SLC9A1KEAP1TSHRNPSR1RXFP1
Fluoride Ion SCHEMBL6345 0.97 SLC9A1 (0.49) SLC9A1KEAP1TSHRNPSR1RXFP1
Bromide SCHEMBL30556235 0.97 SLC9A1 (0.49) SLC9A1KEAP1TSHRNPSR1RXFP1
Phosphine SCHEMBL30298295 0.97 SLC9A1 (0.49) SLC9A1KEAP1TSHRNPSR1RXFP1
SCHEMBL1497619 0.92 SLC9A1 (0.45) SLC9A1KEAP1TSHRNPSR1RXFP1
SCHEMBL28432280 0.92 SLC9A1 (0.45) SLC9A1KEAP1TSHRNPSR1RXFP1
SCHEMBL29352246 0.92 SLC9A1 (0.45) SLC9A1KEAP1TSHRNPSR1RXFP1
SCHEMBL7270165 0.91 SLC9A1 (0.44) SLC9A1KEAP1TSHRNPSR1RXFP1
SCHEMBL936125 0.90 SLC9A1 (0.42) SLC9A1KEAP1TSHRNPSR1RXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10752977-B2 Palladium separating agent, method for producing same and use of same TOSOH CORPORATION (JP) 2020-08-25 US disclosed
EP-2765208-B1 PALLADIUM SEPARATING AGENT, METHOD FOR PRODUCING SAME AND USE OF SAME TOSOH CORP (JP) 2017-02-01 EP disclosed
EP-2231621-B1 PROCESS FOR PREPARING N-SUBSTITUTED HYDROXYPYRIMIDINONE CARBOXAMIDES MERCK SHARP & DOHME (US) 2016-11-02 EP disclosed
US-20160152607-A1 MALEIC ACID DERIVATIVE, PRODUCTION METHOD FOR SAME, AND ANTI-CANCER COMPOSITION COMPRISING SAME KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2016-06-02 US disclosed
EP-3006428-A1 NOVEL MALEIC ACID DERIVATIVE, PRODUCTION METHOD FOR SAME AND ANTI-CANCER COMPOSITION COMPRISING SAME Medicinal Bioconvergence Research Center (KR) 2016-04-13 EP disclosed
US-20140248198-A1 PALLADIUM SEPARATING AGENT, METHOD FOR PRODUCING SAME AND USE OF SAME TOSOH CORPORATION (JP) 2014-09-04 US disclosed
EP-2765208-A1 PALLADIUM SEPARATING AGENT, METHOD FOR PRODUCING SAME AND USE OF SAME Tosoh Corporation (JP) 2014-08-13 EP disclosed
US-20100280244-A1 PROCESS FOR PREPARING N-SUBSTITUTED HYDROXYPYRIMIDINONE CARBOXAMIDES MERCK SHARP & DOHME LLC 2010-11-04 US disclosed
EP-1274696-A1 OXIME DERIVATIVES FOR CONTROLLING UNDESIRED MICROORGANISMS AND ANIMAL PESTS Bayer CropScience AG (DE) 2003-01-15 EP disclosed
WO-2001072726-A1 OXIME DERIVATIVES FOR CONTROLLING UNDESIRED MICROORGANISMS AND ANIMAL PESTS BAYER AKTIENGESELLSCHAFT (DE) 2001-10-04 WO disclosed
EP-0816379-A2 DNA binding oligomers BAYER AG (DE) 1998-01-07 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 (3 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-10752977-B2 Palladium separating agent, method for producing same and use of same CCNA1, DDT, CCNE1 SLC9A1 1198/4885KEAP1 1929/4885TSHR 3652/4885
US-20100280244-A1 PROCESS FOR PREPARING N-SUBSTITUTED HYDROXYPYRIMIDINONE CARBOXAMIDES ALKBH3, DTYMK, DUT SLC9A1 3879/4885KEAP1 4260/4885TSHR 4744/4885
US-20160152607-A1 MALEIC ACID DERIVATIVE, PRODUCTION METHOD FOR SAME, AND ANTI-CANCER COMPOSITION COMPRISING SAME NR1H4, CBR1, NR1H2 SLC9A1 939/4885KEAP1 1298/4885TSHR 1675/4885

“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.