Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6573566

CS(=O)(=O)Nc1ccc(NC(=O)C[n+]2ccccc2)cc1O.[Cl-]

nearest known ligand 0.53

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 9)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 6/20 0.53
KMT2A Q03164 4/20 0.50
BACE1 P56817 3/20 0.49
MEN1 O00255 1/20 0.48
POLB P06746 1/20 0.45
ALDH1A1 P00352 2/20 0.45
MAPK1 P28482 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
LMNA P02545 1/20 0.43

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
SCHEMBL6574945 0.99 HSP90AA1 (0.51) HSP90AA1KMT2ABACE1MEN1POLB
Hydrochloric Acid SCHEMBL6942865 0.86 HSP90AA1 (0.57) HSP90AA1KMT2ABACE1MEN1POLB
Hydrochloric Acid SCHEMBL7160921 0.86 HSP90AA1 (0.57) HSP90AA1KMT2ABACE1MEN1POLB
SCHEMBL7805134 0.85 HSP90AA1 (0.55) HSP90AA1KMT2ABACE1MEN1ALDH1A1
SCHEMBL6939800 0.85 HSP90AA1 (0.55) HSP90AA1KMT2ABACE1MEN1POLB
Hydrochloric Acid SCHEMBL6939938 0.84 HSP90AA1 (0.56) HSP90AA1KMT2ABACE1MEN1POLB
SCHEMBL6944175 0.83 HSP90AA1 (0.54) HSP90AA1KMT2ABACE1MEN1POLB
Hydrochloric Acid SCHEMBL6941279 0.82 HSP90AA1 (0.60) HSP90AA1KMT2ABACE1MEN1POLB
Hydrochloric Acid SCHEMBL6944452 0.81 HSP90AA1 (0.53) HSP90AA1KMT2ABACE1MEN1POLB
SCHEMBL6946198 0.81 HSP90AA1 (0.57) HSP90AA1KMT2ABACE1MEN1POLB

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-1066264-B1 NOVEL CATIONIC 2-SULPHONYLAMINOPHENOLS, THEIR USE AS COUPLERS FOR OXIDATION DYEING, COMPOSITIONS CONTAINING THEM AND DYEING METHODS OREAL (FR) 2004-11-17 EP 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-6537329-B1 Intense colorations with a wide range of colours, excellent colorfastness L'OREAL S.A. (FR) 2003-03-25 US disclosed