Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5221414

CCn1c(N=NC(C)=NN=c2ccccn2C)[n+](CC)c2ccccc21.[Cl-]

nearest known ligand 0.31

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 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
Hydrochloric Acid SCHEMBL5222032 0.89 ALDH1A1 (0.30) ALDH1A1POLBHPGDSMN1; SMN2L3MBTL1
Hydrochloric Acid SCHEMBL5216410 0.87
Hydrochloric Acid SCHEMBL5220811 0.84 ALDH1A1 (0.31) ALDH1A1POLBHPGDSMN1; SMN2L3MBTL1
Hydrochloric Acid SCHEMBL4804279 0.78 KDM4E (0.38) ALDH1A1L3MBTL1
SCHEMBL5197825 0.76 KDM4E (0.39) ALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL4803365 0.72 KDM4E (0.43) L3MBTL1
Hydrochloric Acid SCHEMBL5226294 0.72 OPRM1 (0.31)
Hydrochloric Acid SCHEMBL5224085 0.72 KDM4E (0.30)
Hydrochloric Acid SCHEMBL4804902 0.69 KDM4E (0.34) ALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL1151664 0.68 KDM4E (0.56)

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
EP-1548006-B1 Synthesis of tetraazapentamethine derivatives, keratin fibers dyeing process which uses such synthesis OREAL (FR) 2007-09-05 EP claimed