Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7933382

CC(C[Zr+2](CC(C)c1ccccc1)C1=CC=CC1)c1ccccc1.[Cl-].[Cl-]

nearest known ligand 0.39

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 11)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.39
AOC3 Q16853 2/20 0.36
MAOA P21397 3/20 0.36
MAOB P27338 3/20 0.36
NISCH Q9Y2I1 3/20 0.36
TRPA1 O75762 4/20 0.35
RIPK1 Q13546 1/20 0.35
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GFER P55789 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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 SCHEMBL6917363 0.73 HTR2A (0.31)
SCHEMBL4624071 0.69 TAAR1 (0.44) TAAR1AOC3MAOAMAOBNISCH
Hydrochloric Acid SCHEMBL9077192 0.67
Hydrochloric Acid SCHEMBL8041751 0.66 TSHR (0.31)
Hydrochloric Acid SCHEMBL7933384 0.65 TAAR1 (0.40) TAAR1AOC3MAOAMAOBNISCH
Hydrochloric Acid SCHEMBL7169728 0.64
Hydrochloric Acid SCHEMBL3680366 0.63
SCHEMBL9302592 0.62 TYR (0.39) TAAR1KDM4EL3MBTL1
Hydrochloric Acid SCHEMBL7060706 0.62
Hydrochloric Acid SCHEMBL647873 0.62

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-0791607-B1 Substituted metallocene catalyst for the (co)polymerization of olefins ENICHEM SPA (IT) 2001-05-02 EP disclosed
US-5936051-A FORMING POLYMERS OF HIGH MOLECULAR WEIGHT; CHEMICAL AND HEAT RESISTANCE; ALUMOXANE COCATALYSTS ENICHEM S.P.A. (IT) 1999-08-10 US disclosed
EP-0791607-A2 Substituted metallocene catalyst for the (co)polymerization of olefins ENICHEM S.p.A. (IT) 1997-08-27 EP disclosed