Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6943286

CC(=O)Nc1ccc(N(O)C(=O)C[n+]2ccccc2)cc1Cl.[Cl-]

nearest known ligand 0.45

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 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.45
ALDH1A1 P00352 5/20 0.44
KMT2A Q03164 5/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
MEN1 O00255 2/20 0.44
MAPK1 P28482 2/20 0.44
MAPT P10636 1/20 0.44
RAB9A P51151 1/20 0.44
CYP2C9 P11712 1/20 0.42
HTT P42858 1/20 0.41
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
BACE1 P56817 1/20 0.39
HSP90AA1 P07900 2/20 0.39
LMNA P02545 1/20 0.38

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
SCHEMBL6945414 0.99 POLB (0.43) POLBALDH1A1KMT2AL3MBTL1MEN1
Hydrochloric Acid SCHEMBL6938954 0.89 ALDH1A1 (0.45) POLBALDH1A1KMT2AL3MBTL1MEN1
SCHEMBL6939441 0.87 ALDH1A1 (0.43) POLBALDH1A1KMT2AL3MBTL1MEN1
Hydrochloric Acid SCHEMBL6941800 0.84 KMT2A (0.56) POLBALDH1A1KMT2AL3MBTL1MEN1
Hydrochloric Acid SCHEMBL6941921 0.84 POLB (0.54) POLBALDH1A1KMT2AMEN1MAPT
SCHEMBL6940425 0.83 KMT2A (0.54) POLBALDH1A1KMT2AL3MBTL1MEN1
SCHEMBL6943691 0.83 POLB (0.52) POLBALDH1A1KMT2AMEN1MAPT
Hydrochloric Acid SCHEMBL6573909 0.82 POLB (0.38) POLBALDH1A1KMT2AMEN1CYP2C9
Hydrochloric Acid SCHEMBL6946554 0.82 SMN1; SMN2 (0.44) POLBALDH1A1KMT2AL3MBTL1MEN1
SCHEMBL6572880 0.81 POLB (0.36) POLBALDH1A1KMT2AMEN1RAB9A

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