Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5348751

C[N+]1(C)CCN(c2ccc(N)cc2)CC(O)C1.[Cl-]

nearest known ligand 0.44

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 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.40
GFER P55789 4/20 0.40
GAA P10253 4/20 0.40
ALDH1A1 P00352 4/20 0.40
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 3/20 0.40
ALOX15 P16050 2/20 0.40
HSD17B10 Q99714 2/20 0.40
MAPK1 P28482 2/20 0.40
CYP3A4 P08684 1/20 0.40
CHRNB2 P17787 1/20 0.40
NFKB1 P19838 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA7 P36544 1/20 0.40
CHRNA4 P43681 1/20 0.40
ADRA2C P18825 1/20 0.40
PTK2B Q14289 1/20 0.40
ESR2 Q92731 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
MEN1 O00255 2/20 0.39

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
SCHEMBL6746054 0.98 MAPT (0.41) MAPTGFERGAAALDH1A1KMT2A
Hydrochloric Acid SCHEMBL5394095 0.82 RAD52 (0.44) MAPTGAAKDM4ETHRBRAD52
SCHEMBL6746065 0.81 RAD52 (0.45) MAPTGAAKDM4EALOX15HSD17B10
Hydrochloric Acid SCHEMBL5350629 0.79 ALOX15 (0.62) MAPTGFERGAAALDH1A1KMT2A
SCHEMBL853367 0.77 AR (0.49) MAPTGFERGAAALDH1A1KMT2A
Hydrochloric Acid SCHEMBL5345900 0.77 ALOX15 (0.60) MAPTGFERGAAALDH1A1KMT2A
SCHEMBL15650766 0.77 AR (0.49) MAPTGFERGAAALDH1A1KMT2A
SCHEMBL33623 0.77 AR (0.49) MAPTGFERGAAALDH1A1KMT2A
SCHEMBL6743986 0.77 ALOX15 (0.64) MAPTGFERGAAALDH1A1KMT2A
Hydrochloric Acid SCHEMBL5393462 0.76 MAPT (0.50) MAPTGFERGAAALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7186277-B2 Composition for dyeing keratin fibres, comprising a cationic para-phenylenediamine derivative substituted with a diazacyclohexane or diazacycloheptane ring L'OREAL SA (FR) 2007-03-06 US disclosed