Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7926764

CC1=C([Hf+2](C2=C(C)C(c3cccc(F)c3)=CC2C)=[Ge](C)C)C(C)C=C1c1cccc(F)c1.[Cl-].[Cl-]

nearest known ligand 0.32

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
ACHE known ✓ P22303 1/20 0.32
TAAR1 Q96RJ0 1/20 0.31
ESR2 Q92731 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA1 P30542 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
PIM1 P11309 1/20 0.30
NISCH Q9Y2I1 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
Hydrochloric Acid SCHEMBL7933141 0.86 ALDH1A1 (0.30) ALDH1A1LMNA
Hydrochloric Acid SCHEMBL7935477 0.86 NISCH (0.33) ACHENISCH
Hydrochloric Acid SCHEMBL7936818 0.83
Hydrochloric Acid SCHEMBL7936900 0.81 ALDH1A1 (0.33) ACHETAAR1ESR2ALDH1A1LMNA
Hydrochloric Acid SCHEMBL27521258 0.77 ACHE (0.37) ACHETAAR1ESR2ADORA2AADORA1
Hydrochloric Acid SCHEMBL27566934 0.76 ACHE (0.36) ACHETAAR1ESR2NISCH
Hydrochloric Acid SCHEMBL27546010 0.74 ACHE (0.35) ACHETAAR1ESR2ADORA2AADORA1
Hydrochloric Acid SCHEMBL27520463 0.74 ACHE (0.35) ACHETAAR1ESR2ADORA2AADORA1
Hydrochloric Acid SCHEMBL27566935 0.73 ACHE (0.36) ACHETAAR1ESR2ADORA2AADORA1
Hydrochloric Acid SCHEMBL27546012 0.73 ACHE (0.36) ACHETAAR1ESR2ADORA2AADORA1

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
US-6184402-B1 RESOLUTION OF A STEREOISOMERIC MIXTURE OF SPECIFIC METALLOCENE COMPLEXES BRIDGED WITH A TRANSITION METAL HAVING AN OXYGEN BOND ATTACHED, I.E., A MU-OXO COMPLEX; HYDROLYSIS IN THE PRESENCE OF A BASE; SEPARATION OF MESO FORM FROM MIXES CHISSO CORPORATION (JP) 2001-02-06 US disclosed