Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6573784

Cc1c(Cl)cc(N(O)C(=O)Cn2cc[n+](CC(=O)N(O)c3cc(Cl)c(C)c(Cl)c3)c2)cc1Cl.[Cl-]

nearest known ligand 0.44

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 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
RECQL P46063 1/20 0.36
HSP90AA1 P07900 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL6572973 0.99 MEN1 (0.37) MEN1KMT2ARECQLHSP90AA1SMN1; SMN2
Hydrochloric Acid SCHEMBL6571891 0.94 MEN1 (0.35) MEN1KMT2ARECQLHSP90AA1
SCHEMBL6574941 0.92 MEN1 (0.36) MEN1KMT2ARECQL
Hydrochloric Acid SCHEMBL6573924 0.88 MEN1 (0.36) MEN1KMT2ARECQL
Hydrochloric Acid SCHEMBL6572670 0.87 MEN1 (0.37) MEN1KMT2ARECQLHSP90AA1SMN1; SMN2
SCHEMBL6573662 0.87 MEN1 (0.37) MEN1KMT2ARECQL
SCHEMBL6572105 0.86 MEN1 (0.38) MEN1KMT2ARECQLHSP90AA1SMN1; SMN2
Hydrochloric Acid SCHEMBL6573701 0.85 LMNA (0.38) MEN1KMT2ARECQLHSP90AA1SMN1; SMN2
Hydrochloric Acid SCHEMBL6941779 0.85 LMNA (0.40) SMN1; SMN2
Hydrochloric Acid SCHEMBL7628910 0.85 LMNA (0.37) MEN1KMT2ARECQL

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