Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5351935

CC[N+]1(CCO)CCN(c2ccc(N)cc2)CC1.[Cl-]

nearest known ligand 0.52

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
CHRNA10 Q9GZZ6 11/20 0.52
CHRNA9 Q9UGM1 11/20 0.52
CHRNA7 P36544 9/20 0.52
GFER P55789 4/20 0.47
MAPT P10636 4/20 0.47
KDM4E B2RXH2 3/20 0.47
GAA P10253 3/20 0.47
RAD52 P43351 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ALDH1A1 P00352 3/20 0.44
KMT2A Q03164 2/20 0.44
ADRA2C P18825 1/20 0.44
PTK2B Q14289 1/20 0.44
ESR2 Q92731 1/20 0.44
CASP6 P55212 1/20 0.42
HTT P42858 2/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
USP2 O75604 1/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL6745286 0.98 CHRNA10 (0.54) CHRNA10CHRNA9CHRNA7GFERMAPT
Hydrochloric Acid SCHEMBL5352676 0.95 CHRNA10 (0.48) CHRNA10CHRNA9CHRNA7GFERMAPT
SCHEMBL6742112 0.93 CHRNA10 (0.49) CHRNA10CHRNA9CHRNA7GFERMAPT
Hydrochloric Acid SCHEMBL5364443 0.91 MAPT (0.46) CHRNA10CHRNA9CHRNA7GFERMAPT
SCHEMBL6744015 0.89 MAPT (0.47) CHRNA10CHRNA9CHRNA7GFERMAPT
Hydrochloric Acid SCHEMBL5410295 0.85 MAPT (0.49) CHRNA10CHRNA9CHRNA7GFERMAPT
SCHEMBL6744328 0.84 MAPT (0.50) CHRNA10CHRNA9CHRNA7GFERMAPT
Hydrochloric Acid SCHEMBL5345795 0.82 GAA (0.53) CHRNA10CHRNA9CHRNA7MAPTKDM4E
Hydrochloric Acid SCHEMBL5349721 0.82 MAPT (0.46) CHRNA10CHRNA9CHRNA7GFERMAPT
SCHEMBL6746574 0.81 GAA (0.55) CHRNA10CHRNA9CHRNA7MAPTKDM4E

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