Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6942113

CC(=O)Nc1c(Cl)cc(N(O)C(=O)Cn2cc[n+](C)c2)cc1Cl.[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
LMNA P02545 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALDH1A1 P00352 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
HTT P42858 1/20 0.31
THRB P10828 1/20 0.30
HPGD P15428 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
SCHEMBL6946393 0.99 LMNA (0.37) LMNASMN1; SMN2ALDH1A1L3MBTL1MEN1
Hydrochloric Acid SCHEMBL6945516 0.90 LMNA (0.36) LMNASMN1; SMN2ALDH1A1L3MBTL1MEN1
SCHEMBL6946299 0.89 LMNA (0.36) LMNASMN1; SMN2ALDH1A1L3MBTL1MEN1
Hydrochloric Acid SCHEMBL6573701 0.87 LMNA (0.38) LMNASMN1; SMN2ALDH1A1L3MBTL1MEN1
Hydrochloric Acid SCHEMBL6944704 0.87 LMNA (0.37) LMNASMN1; SMN2ALDH1A1L3MBTL1POLB
SCHEMBL6573683 0.86 LMNA (0.36) LMNASMN1; SMN2ALDH1A1L3MBTL1MEN1
SCHEMBL6946188 0.86 SMN1; SMN2 (0.38) LMNASMN1; SMN2ALDH1A1POLBRAB9A
Hydrochloric Acid SCHEMBL6941779 0.85 LMNA (0.40) LMNASMN1; SMN2L3MBTL1THRBHPGD
Hydrochloric Acid SCHEMBL6946260 0.84 LMNA (0.39) LMNASMN1; SMN2ALDH1A1L3MBTL1THRB
SCHEMBL6941332 0.83 LMNA (0.40) LMNASMN1; SMN2L3MBTL1MEN1MAPT

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-1066022-B1 COMPOSITIONS FOR OXIDATION DYEING KERATIN FIBRES COMPRISING A CATIONIC COUPLER, NOVEL CATIONIC COUPLERS, THEIR USE FOR OXIDATION DYEING AND DYEING METHODS OREAL (FR) 2003-10-22 EP claimed
US-6544298-B1 Dyeing human hair using coupler L'OREAL (FR) 2003-04-08 US claimed
US-6544298-B1 Dyeing human hair using coupler L'OREAL (FR) 2003-04-08 US disclosed