Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6596513

O=C(C[n+]1cccc(-c2cc(-c3ccccc3)n[nH]2)c1)c1cccs1.[Cl-]

nearest known ligand 0.43

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
RAB9A P51151 3/20 0.43
POLB P06746 2/20 0.43
MAPT P10636 3/20 0.40
HCRTR1 O43613 2/20 0.40
NPC1 O15118 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MAPK8 P45983 1/20 0.38
ALOX15 P16050 2/20 0.38
ADORA3 P0DMS8 1/20 0.38
TP53 P04637 2/20 0.37
ITK Q08881 1/20 0.37
ALDH1A1 P00352 3/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
HPGD P15428 1/20 0.36
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL6598001 0.95 ALDH1A1 (0.38) RAB9APOLBMAPTHCRTR1NPC1
Hydrochloric Acid SCHEMBL5365087 0.87 KMT2A (0.42) RAB9APOLBMAPTHCRTR1NPC1
Hydrochloric Acid SCHEMBL6611866 0.85 POLB (0.38) RAB9APOLBMAPTHCRTR1NPC1
Hydrochloric Acid SCHEMBL3686641 0.84 ALDH1A1 (0.38) RAB9APOLBMAPTNPC1SMN1; SMN2
Hydrochloric Acid SCHEMBL6609904 0.81 POLB (0.34) RAB9APOLBMAPTHCRTR1NPC1
Hydrochloric Acid SCHEMBL6596505 0.80 RAB9A (0.40) RAB9APOLBMAPTHCRTR1NPC1
Bromide SCHEMBL6826247 0.79 MAPT (0.35) RAB9APOLBMAPTHCRTR1NPC1
Hydrochloric Acid SCHEMBL6609297 0.77 ALOX5 (0.35) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1
Hydrochloric Acid SCHEMBL1194570 0.77 KMT2A (0.41) RAB9AMAPTNPC1SMN1; SMN2ALDH1A1
SCHEMBL6599925 0.76 KMT2A (0.42) RAB9AMAPTNPC1SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1373263-B1 HETEROCYCLIC COMPOUNDS FOR AGING-RELATED AND DIABETIC VASCULAR COMPLICATIONS TORRENT PHARMACEUTICALS LTD (IN) 2004-10-27 EP claimed
WO-2002085897-A9 HETEROCYCLIC COMPOUNDS FOR AGING-RELATED AND DIABETIC VASCULAR COMPLICATIONS SANKARANARAYANAN ALANGUDI (IN) 2004-04-01 WO claimed
EP-1373263-A1 HETEROCYCLIC COMPOUNDS FOR AGING-RELATED AND DIABETIC VASCULAR COMPLICATIONS Torrent Pharmaceuticals Ltd (IN) 2004-01-02 EP claimed
US-20030045554-A1 Novel compounds for the management of aging-related and diabetic vascular complications, process for their preparation, therapeutic and cosmetic uses thereof TORRENT PHARMACEUTICALS LTD. 2003-03-06 US claimed
WO-2002085897-A1 HETEROCYCLIC COMPOUNDS FOR AGING-RELATED AND DIABETIC VASCULAR COMPLICATIONS SANKARANARAYANAN ALANGUDI (IN) 2002-10-31 WO 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-20030045554-A1 Novel compounds for the management of aging-related and diabetic vascular complications, process for their preparation, therapeutic and cosmetic uses thereof AGER, GLA, F12 RAB9A 2380/4885POLB 884/4885MAPT 4105/4885

“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.