Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6571648

Nc1cc(N)c(NC(=O)Cn2cc[n+](CC(=O)Nc3c(N)cc(N)cc3O)c2)c(O)c1.[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 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
RECQL P46063 1/20 0.36
LMNA P02545 2/20 0.35
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
RAB9A P51151 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HTT P42858 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
SCHEMBL6575589 0.99 MEN1 (0.37) MEN1KMT2ARECQLLMNAALDH1A1
Hydrochloric Acid SCHEMBL6943223 0.86 LMNA (0.38) LMNA
Hydrochloric Acid SCHEMBL6575506 0.85 MEN1 (0.33) MEN1KMT2ARECQLLMNAALDH1A1
SCHEMBL6944197 0.84 LMNA (0.39) LMNA
SCHEMBL6573730 0.84 MEN1 (0.34) MEN1KMT2ARECQLLMNAALDH1A1
Hydrochloric Acid SCHEMBL6574924 0.83 KMT2A (0.41) MEN1KMT2ARECQLLMNAALDH1A1
Hydrochloric Acid SCHEMBL6572916 0.82 RAD52 (0.39) MEN1KMT2ARECQLLMNAALDH1A1
SCHEMBL6573847 0.82 MEN1 (0.42) MEN1KMT2ARECQLLMNAALDH1A1
SCHEMBL6573686 0.81 RAD52 (0.39) MEN1KMT2ARECQLLMNAALDH1A1
Hydrochloric Acid SCHEMBL6939393 0.78 KMT2A (0.56) MEN1KMT2ALMNAALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1066263-B1 NOVEL CATIONIC 2-ACYLAMINOPHENOLS, THEIR USE AS COUPLER FOR OXIDATION DYEING, COMPOSITIONS CONTAINING THEM, AND DYEING METHODS OREAL (FR) 2004-05-26 EP claimed
US-6455737-B1 CATIONIC DYES AND OXIDATION BASES HAVING INTENSE SHADES OR COLORS AND COLORFASTNESS USED ON HUMAN KERATIN FIBERS SUCH AS HAIR; MULTICOMPARTMENT KITS L'OREAL S.A. (FR) 2002-09-24 US claimed
US-6455737-B1 CATIONIC DYES AND OXIDATION BASES HAVING INTENSE SHADES OR COLORS AND COLORFASTNESS USED ON HUMAN KERATIN FIBERS SUCH AS HAIR; MULTICOMPARTMENT KITS L'OREAL S.A. (FR) 2002-09-24 US disclosed