Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6571891

Cc1ccc(N(O)C(=O)C[n+]2ccn(CC(=O)N(O)c3cc(Cl)c(C)c(Cl)c3)c2)cc1.[Cl-]

nearest known ligand 0.42

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 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
RECQL P46063 1/20 0.35
KMT2A Q03164 1/20 0.35
RAB9A P51151 1/20 0.33
POLB P06746 1/20 0.33
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30
HSP90AA1 P07900 1/20 0.30

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
SCHEMBL6574941 0.99 MEN1 (0.36) MEN1RECQLKMT2ARAB9APOLB
Hydrochloric Acid SCHEMBL6573784 0.94 MEN1 (0.36) MEN1RECQLKMT2AHSP90AA1
SCHEMBL6572973 0.92 MEN1 (0.37) MEN1RECQLKMT2AHSP90AA1
Hydrochloric Acid SCHEMBL6575342 0.90 MEN1 (0.41) MEN1RECQLKMT2ARAB9APOLB
SCHEMBL6572677 0.89 MEN1 (0.42) MEN1RECQLKMT2ARAB9APOLB
Hydrochloric Acid SCHEMBL6572670 0.86 MEN1 (0.37) MEN1RECQLKMT2ARAB9ALMNA
SCHEMBL6572105 0.85 MEN1 (0.38) MEN1RECQLKMT2ARAB9ALMNA
Hydrochloric Acid SCHEMBL6572737 0.85 MEN1 (0.38) MEN1RECQLKMT2ARAB9APOLB
Hydrochloric Acid SCHEMBL6572788 0.83 MEN1 (0.38) MEN1RECQLKMT2A
Hydrochloric Acid SCHEMBL6573924 0.82 MEN1 (0.36) MEN1RECQLKMT2A

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