Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5363423

Cc1ccc(C(=O)C[n+]2cccc(-c3cc(CSc4ccccc4)n[nH]3)c2)s1.[Cl-]

nearest known ligand 0.36

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
ALDH1A1 P00352 4/20 0.36
LMNA P02545 3/20 0.36
KDM4E B2RXH2 2/20 0.36
KMT2A Q03164 3/20 0.34
PABPC1 P11940 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 9/20 0.33
MAPT P10636 7/20 0.33
HTT P42858 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
TDP1 Q9NUW8 2/20 0.32
RAB9A P51151 1/20 0.32
GLA P06280 1/20 0.31
POLB P06746 2/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
APEX1 P27695 1/20 0.31
RECQL P46063 1/20 0.31
NPY1R P25929 1/20 0.31

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 SCHEMBL1194041 0.86 ALDH1A1 (0.38) ALDH1A1LMNAKDM4EKMT2APABPC1
Hydrochloric Acid SCHEMBL1194173 0.85 ALDH1A1 (0.37) ALDH1A1LMNAKDM4EKMT2APABPC1
SCHEMBL6595709 0.85 ALDH1A1 (0.38) ALDH1A1LMNAKDM4EKMT2APABPC1
SCHEMBL6598073 0.84 ALDH1A1 (0.38) ALDH1A1LMNAKDM4EKMT2APABPC1
Hydrochloric Acid SCHEMBL1193915 0.82 KMT2A (0.35) ALDH1A1LMNAKDM4EKMT2APABPC1
SCHEMBL6596187 0.81 KMT2A (0.35) ALDH1A1LMNAKDM4EKMT2APABPC1
Hydrochloric Acid SCHEMBL1194171 0.80 ACHE (0.32) ALDH1A1LMNAKDM4E
Hydrochloric Acid SCHEMBL1193715 0.79 MAPT (0.34) ALDH1A1LMNAKDM4EKMT2AMAPT
SCHEMBL6599195 0.79 ACHE (0.32) ALDH1A1LMNAKDM4E
Hydrochloric Acid SCHEMBL6599921 0.78 LMNA (0.34) ALDH1A1LMNAKDM4EKMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070167493-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. 2007-07-19 US disclosed
US-7223777-B2 Compounds for the management of aging-related and diabetic vascular complications, process for their preparation, therapeutic and cosmetic uses thereof TORRENT PHARMACEUTICALS LTD. (IN) 2007-05-29 US disclosed
EP-1373263-B1 HETEROCYCLIC COMPOUNDS FOR AGING-RELATED AND DIABETIC VASCULAR COMPLICATIONS TORRENT PHARMACEUTICALS LTD (IN) 2004-10-27 EP disclosed
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 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-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 ALDH1A1 132/4885LMNA 641/4885KDM4E 639/4885
US-20070167493-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 ALDH1A1 226/4885LMNA 480/4885KDM4E 658/4885

“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.