Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6575342

Cc1ccc(N(O)C(=O)Cn2cc[n+](CC(=O)N(O)c3ccc(C)cc3)c2)cc1.[Cl-]

nearest known ligand 0.41

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 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
RECQL P46063 1/20 0.41
RAB9A P51151 1/20 0.40
POLB P06746 2/20 0.38
LMNA P02545 3/20 0.34
ALDH1A1 P00352 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
HSP90AA1 P07900 3/20 0.33
MAPT P10636 1/20 0.33
UBE2N P61088 1/20 0.33
GFER P55789 1/20 0.30
HTT P42858 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
SCHEMBL6572677 0.99 MEN1 (0.42) MEN1KMT2ARECQLRAB9APOLB
Hydrochloric Acid SCHEMBL6572737 0.94 MEN1 (0.38) MEN1KMT2ARECQLRAB9APOLB
Hydrochloric Acid SCHEMBL6571891 0.90 MEN1 (0.35) MEN1KMT2ARECQLRAB9APOLB
SCHEMBL6574941 0.89 MEN1 (0.36) MEN1KMT2ARECQLRAB9APOLB
Hydrochloric Acid SCHEMBL6572948 0.87 MEN1 (0.41) MEN1KMT2ARECQLLMNASMN1; SMN2
SCHEMBL6573697 0.86 MEN1 (0.42) MEN1KMT2ARECQLLMNASMN1; SMN2
SCHEMBL6574295 0.85 KMT2A (0.53) MEN1KMT2ARECQLRAB9APOLB
Hydrochloric Acid SCHEMBL6573128 0.84 KMT2A (0.38) MEN1KMT2ARECQLLMNAALDH1A1
Hydrochloric Acid SCHEMBL6946401 0.84 LMNA (0.45) MEN1KMT2ARAB9ALMNAALDH1A1
Hydrochloric Acid SCHEMBL6572670 0.83 MEN1 (0.37) MEN1KMT2ARECQLRAB9ALMNA

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