Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7154666

COc1cc(NS(=O)(=O)c2ccccc2)c(O)cc1NC(=O)C[n+]1ccccc1.[Cl-]

nearest known ligand 0.58

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 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.58
ALDH1A1 P00352 7/20 0.53
KMT2A Q03164 7/20 0.53
ATM Q13315 1/20 0.47
HSP90AA1 P07900 2/20 0.47
MEN1 O00255 3/20 0.46
KDM4E B2RXH2 1/20 0.46
HSD17B10 Q99714 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MAPK1 P28482 3/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
EGFR P00533 1/20 0.43
ERBB2 P04626 1/20 0.43
ERBB4 Q15303 1/20 0.43
MAPT P10636 2/20 0.43
LMNA P02545 1/20 0.43
AHR P35869 1/20 0.42
TP53 P04637 1/20 0.42

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
SCHEMBL7805078 0.99 POLB (0.57) POLBALDH1A1KMT2AATMHSP90AA1
Hydrochloric Acid SCHEMBL6574257 0.87 POLB (0.57) POLBALDH1A1KMT2AATMHSP90AA1
SCHEMBL6573637 0.86 POLB (0.55) POLBALDH1A1KMT2AATMHSP90AA1
Hydrochloric Acid SCHEMBL7154981 0.84 L3MBTL1 (0.51) POLBALDH1A1KMT2AHSP90AA1MEN1
SCHEMBL7806186 0.83 L3MBTL1 (0.49) POLBALDH1A1KMT2AHSP90AA1MEN1
Hydrochloric Acid SCHEMBL6940856 0.82 POLB (0.60) POLBALDH1A1KMT2AATMHSP90AA1
Hydrochloric Acid SCHEMBL6942987 0.82 POLB (0.60) POLBALDH1A1KMT2AATMHSP90AA1
Hydrochloric Acid SCHEMBL6946096 0.82 POLB (0.60) POLBALDH1A1KMT2AATMHSP90AA1
Hydrochloric Acid SCHEMBL6941908 0.82 POLB (0.60) POLBALDH1A1KMT2AATMHSP90AA1
SCHEMBL6806837 0.81 ALDH1A1 (0.66) ALDH1A1KMT2AMEN1KDM4EHSD17B10

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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