Hydrochloric Acid

Hydrochloric Acid

SCHEMBL8501661

Cc1ccc([N+]#N)cc1Br.[Cl-]

nearest known ligand 0.36

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 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
HPGD P15428 4/20 0.33
TSHR P16473 1/20 0.32
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
POLB P06746 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL8501838 0.98 ALDH1A1 (0.37) ALDH1A1HPGDTSHRNPC1RAB9A
SCHEMBL11748723 0.77 ALDH1A1 (0.40) ALDH1A1HPGDTSHRNPC1RAB9A
SCHEMBL12383641 0.76 ALDH1A1 (0.37) ALDH1A1HPGDTSHRNPC1RAB9A
SCHEMBL14733276 0.71 ALOX15 (0.50) HPGD
SCHEMBL31727453 0.71 HDAC1 (0.37) ALDH1A1TSHRNPC1RAB9ASMN1; SMN2
SCHEMBL15357893 0.71 GABRA1 (0.33)
SCHEMBL23529793 0.70 HTT (0.35) ALDH1A1
SCHEMBL31619918 0.70 HTT (0.35) ALDH1A1
Hydrochloric Acid SCHEMBL10953239 0.68
Hydrochloric Acid SCHEMBL10952207 0.68

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0599270-B1 Method of detecting phosphatase AISIN SEIKI (JP) 1999-05-12 EP claimed
EP-0599270-A2 Method of detecting phosphatase AISIN SEIKI KABUSHIKI KAISHA (JP) 1994-06-01 EP claimed
EP-0599270-B1 Method of detecting phosphatase AISIN SEIKI (JP) 1999-05-12 EP disclosed
US-5480791-A Method of detecting phosphatase AISIN SEIKI KABUSHIKI KAISHA (JP) 1996-01-02 US disclosed
EP-0599270-A2 Method of detecting phosphatase AISIN SEIKI KABUSHIKI KAISHA (JP) 1994-06-01 EP disclosed