Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5602374

CC1=C(C)C(C)=C([Hf+2]C2C(n3ccc4ccccc43)=Cc3ccccc32)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 15)

geneUniProtsupporting neighboursconfidence
BIRC5 O15392 1/20 0.32
PRKD3 O94806 1/20 0.31
PRKCG P05129 1/20 0.31
PRKCB P05771 1/20 0.31
PRKCA P17252 1/20 0.31
PRKACA P17612 1/20 0.31
PRKACG P22612 1/20 0.31
PRKACB P22694 1/20 0.31
PRKCH P24723 1/20 0.31
PRKCI P41743 1/20 0.31
PRKCE Q02156 1/20 0.31
PRKCQ Q04759 1/20 0.31
PRKCZ Q05513 1/20 0.31
PRKCD Q05655 1/20 0.31
PRKD1 Q15139 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 SCHEMBL5602483 0.84 BIRC5 (0.31) BIRC5PRKD3PRKCGPRKCBPRKCA
Hydrochloric Acid SCHEMBL5602876 0.84 MAPT (0.31)
Hydrochloric Acid SCHEMBL5602535 0.82 BIRC5 (0.31) BIRC5PRKD3PRKCGPRKCBPRKCA
Hydrochloric Acid SCHEMBL5601730 0.82
Hydrochloric Acid SCHEMBL5603660 0.79
Hydrochloric Acid SCHEMBL5603156 0.78 BIRC5 (0.41) BIRC5PRKD3PRKCGPRKCBPRKCA
Hydrochloric Acid SCHEMBL5602001 0.78 BIRC5 (0.32) BIRC5PRKD3PRKCGPRKCBPRKCA
Hydrochloric Acid SCHEMBL5600676 0.77 ALDH1A1 (0.30)
Hydrochloric Acid SCHEMBL5603333 0.77 BIRC5 (0.32) BIRC5
Hydrochloric Acid SCHEMBL5603415 0.76 PRKD3 (0.31) PRKD3PRKCGPRKCBPRKCAPRKACA

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 2 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
US-20050261449-A1 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENT INC. 2005-11-24 US disclosed