Hydrochloric Acid

Hydrochloric Acid

SCHEMBL17847864

CC(=O)C[n+]1ccc(C(C)=O)cc1.[Cl-]

nearest known ligand 0.50

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 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
RCE1 Q9Y256 1/20 0.43
RAB9A P51151 2/20 0.41
ALDH1A1 P00352 3/20 0.40
SMN1; SMN2 Q16637 4/20 0.39
HTT P42858 3/20 0.39
LMNA P02545 3/20 0.39
MAPT P10636 3/20 0.39
HPGD P15428 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
HSD17B1 P14061 1/20 0.38
MITF O75030 1/20 0.37
NR2F2 P24468 1/20 0.37
ATM Q13315 1/20 0.37
USP2 O75604 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL734875 0.98 KMT2A (0.45) KMT2AMEN1RCE1RAB9AALDH1A1
Bromide SCHEMBL144907 0.96 KMT2A (0.47) KMT2AMEN1RCE1RAB9AALDH1A1
Sulfuric Acid SCHEMBL141469 0.87 KMT2A (0.38) KMT2AMEN1RCE1RAB9AALDH1A1
Sulfuric Acid SCHEMBL141470 0.87 KMT2A (0.38) KMT2AMEN1RCE1RAB9AALDH1A1
Hydrochloric Acid SCHEMBL9250120 0.83 HTT (0.42) KMT2AMEN1RCE1RAB9AALDH1A1
Hydrochloric Acid SCHEMBL19031270 0.82 ALDH1A1 (0.47) KMT2AMEN1RCE1RAB9AALDH1A1
SCHEMBL19037386 0.82 KMT2A (0.50) KMT2AMEN1RCE1RAB9ASMN1; SMN2
SCHEMBL14621784 0.82 KMT2A (0.50) KMT2AMEN1RCE1RAB9AALDH1A1
SCHEMBL11925329 0.82 MEN1 (0.64) KMT2AMEN1RCE1RAB9AALDH1A1
SCHEMBL290669 0.82 KMT2A (0.42) KMT2AMEN1RCE1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3233801-B1 USE OF PARTICULAR PYRIDINIUM SALTS FOR THE TREATMENT OF KERATIN SUBSTANCES, COMPOSITIONS AND IMPLEMENTATION METHODS OREAL (FR) 2022-06-08 EP claimed
US-20170340543-A1 USE OF PARTICULAR PYRIDINIUM SALTS FOR THE TREATMENT OF KERATIN SUBSTANCES, COMPOSITIONS AND IMPLEMENTATION METHODS L'OREAL (FR) 2017-11-30 US claimed
EP-3233801-A1 USE OF PARTICULAR PYRIDINIUM SALTS FOR THE TREATMENT OF KERATIN SUBSTANCES, COMPOSITIONS AND IMPLEMENTATION METHODS L'OREAL (FR) 2017-10-25 EP claimed
WO-2016097413-A1 USE OF PARTICULAR PYRIDINIUM SALTS FOR THE TREATMENT OF KERATIN SUBSTANCES, COMPOSITIONS AND IMPLEMENTATION METHODS L'OREAL (FR) 2016-06-23 WO claimed
EP-3233801-B1 USE OF PARTICULAR PYRIDINIUM SALTS FOR THE TREATMENT OF KERATIN SUBSTANCES, COMPOSITIONS AND IMPLEMENTATION METHODS OREAL (FR) 2022-06-08 EP disclosed
CN-106999394-B Use, composition and implementation method of specific pyridinium salt for treating keratin materials 欧莱雅 2021-09-24 CN disclosed
US-10765615-B2 Use of particular pyridinium salts for the treatment of keratin substances, compositions and implementation methods L'OREAL (FR) 2020-09-08 US disclosed
US-20170340543-A1 USE OF PARTICULAR PYRIDINIUM SALTS FOR THE TREATMENT OF KERATIN SUBSTANCES, COMPOSITIONS AND IMPLEMENTATION METHODS L'OREAL (FR) 2017-11-30 US disclosed
EP-3233801-A1 USE OF PARTICULAR PYRIDINIUM SALTS FOR THE TREATMENT OF KERATIN SUBSTANCES, COMPOSITIONS AND IMPLEMENTATION METHODS L'OREAL (FR) 2017-10-25 EP disclosed
WO-2016097413-A1 USE OF PARTICULAR PYRIDINIUM SALTS FOR THE TREATMENT OF KERATIN SUBSTANCES, COMPOSITIONS AND IMPLEMENTATION METHODS L'OREAL (FR) 2016-06-23 WO 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-20170340543-A1 USE OF PARTICULAR PYRIDINIUM SALTS FOR THE TREATMENT OF KERATIN SUBSTANCES, COMPOSITIONS AND IMPLEMENTATION METHODS KRT18, PLPBP, PNPO KMT2A 1799/4885MEN1 2850/4885RCE1 4160/4885
US-10765615-B2 Use of particular pyridinium salts for the treatment of keratin substances, compositions and implementation methods KRT18, PLPBP, PNPO KMT2A 1799/4885MEN1 2850/4885RCE1 4160/4885

“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.