Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5603082

C1=CCC([Zr+2]C2C(n3cnc4ccccc43)=Cc3ccccc32)=C1.[Cl-].[Cl-]

nearest known ligand 0.35

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 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.35
HTT P42858 3/20 0.35
MKNK1 Q9BUB5 3/20 0.35
MKNK2 Q9HBH9 3/20 0.35
FGFR1 P11362 3/20 0.34
PIK3CB P42338 1/20 0.33
ROCK1 Q13464 1/20 0.32
MAPK1 P28482 1/20 0.32
LCK P06239 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 SCHEMBL5602988 0.82 RAB9A (0.35)
Hydrochloric Acid SCHEMBL5602330 0.81 HTT (0.34) POLBHTTMKNK1MKNK2FGFR1
Hydrochloric Acid SCHEMBL5601711 0.81
Hydrochloric Acid SCHEMBL5600307 0.81
Hydrochloric Acid SCHEMBL5601577 0.80 POLB (0.44) POLBHTTMKNK1MKNK2FGFR1
Hydrochloric Acid SCHEMBL5601938 0.80
Hydrochloric Acid SCHEMBL5602711 0.79 HTT (0.34) POLBHTTMKNK1MKNK2FGFR1
Hydrochloric Acid SCHEMBL5603542 0.79
Fluoride Ion SCHEMBL5603567 0.78
Bromide SCHEMBL5602024 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US disclosed
EP-1735354-A1 HETEROCYCLIC SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION Exxonmobil Chemical Company Inc. (US) 2006-12-27 EP disclosed
US-20050261449-A1 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENT INC. 2005-11-24 US disclosed
WO-2005105864-A1 HETEROCYCLIC SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2005-11-10 WO disclosed