Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6941749

Nc1ccc(N(O)C(=O)C[n+]2ccccc2)cc1.[Cl-]

nearest known ligand 0.47

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
ACHE known ✓ P22303 2/20 0.39
LMNA P02545 1/20 0.47
RAB9A P51151 2/20 0.43
HSP90AA1 P07900 3/20 0.42
PABPC1 P11940 1/20 0.40
KMT2A Q03164 3/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPK1 P28482 2/20 0.39
POLB P06746 3/20 0.37
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL6944450 0.98 LMNA (0.44) LMNARAB9AHSP90AA1PABPC1KMT2A
SCHEMBL6944437 0.85 HSP90AA1 (0.47) RAB9AHSP90AA1PABPC1KMT2AL3MBTL1
Hydrochloric Acid SCHEMBL6940021 0.84 BACE1 (0.47) LMNARAB9AHSP90AA1PABPC1KMT2A
SCHEMBL6945422 0.83 BACE1 (0.45) LMNARAB9AHSP90AA1PABPC1KMT2A
Hydrochloric Acid SCHEMBL6945717 0.81 KMT2A (0.44) LMNARAB9AHSP90AA1PABPC1KMT2A
Hydrochloric Acid SCHEMBL6942876 0.81 KMT2A (0.61) LMNAHSP90AA1KMT2AL3MBTL1ALDH1A1
Hydrochloric Acid SCHEMBL6939400 0.81 LMNA (0.38) LMNARAB9AHSP90AA1PABPC1KMT2A
SCHEMBL6940502 0.80 PABPC1 (0.42) LMNARAB9AHSP90AA1PABPC1KMT2A
SCHEMBL6944670 0.79 RAB9A (0.38) LMNARAB9AHSP90AA1PABPC1KMT2A
SCHEMBL6939815 0.79 KMT2A (0.59) LMNAHSP90AA1KMT2AL3MBTL1ALDH1A1

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 5 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-6537329-B1 Intense colorations with a wide range of colours, excellent colorfastness L'OREAL S.A. (FR) 2003-03-25 US claimed
US-6544298-B1 Dyeing human hair using coupler L'OREAL (FR) 2003-04-08 US disclosed
US-6537329-B1 Intense colorations with a wide range of colours, excellent colorfastness L'OREAL S.A. (FR) 2003-03-25 US disclosed