Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6946260

C[n+]1ccn(CC(=O)N(O)c2cc(Cl)c(N)c(Cl)c2)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 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HPGD P15428 3/20 0.33
THRB P10828 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
FDPS P14324 2/20 0.32
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
GAA P10253 2/20 0.31
GLA P06280 1/20 0.31
HSD11B1 P28845 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL6944222 0.99 LMNA (0.40) LMNASMN1; SMN2HPGDTHRBL3MBTL1
Hydrochloric Acid SCHEMBL6941779 0.89 LMNA (0.40) LMNASMN1; SMN2HPGDTHRBL3MBTL1
SCHEMBL6941332 0.88 LMNA (0.40) LMNASMN1; SMN2HPGDTHRBL3MBTL1
Hydrochloric Acid SCHEMBL6941393 0.87 LMNA (0.39) LMNASMN1; SMN2HPGDTHRBL3MBTL1
SCHEMBL6937083 0.86 LMNA (0.40) LMNASMN1; SMN2HPGDTHRBL3MBTL1
Hydrochloric Acid SCHEMBL6573924 0.84 MEN1 (0.36)
Hydrochloric Acid SCHEMBL6942113 0.84 LMNA (0.36) LMNASMN1; SMN2HPGDTHRBL3MBTL1
Hydrochloric Acid SCHEMBL6940898 0.83 LMNA (0.40) LMNASMN1; SMN2HPGDTHRBL3MBTL1
SCHEMBL6573662 0.83 MEN1 (0.37)
Hydrochloric Acid SCHEMBL6945516 0.83 LMNA (0.36) LMNASMN1; SMN2HPGDTHRBL3MBTL1

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-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-6544298-B1 Dyeing human hair using coupler L'OREAL (FR) 2003-04-08 US disclosed