Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5603350

Cc1cc2ccccc2n1-c1cccc2c1C=CC2[Zr+2]C1C=Cc2c1cccc2-n1c(C)cc2ccccc21.[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 5)

geneUniProtsupporting neighboursconfidence
SLC6A2 known ✓ P23975 1/20 0.32
KDM4E B2RXH2 1/20 0.32
KLK7 P49862 1/20 0.32
MAPT P10636 2/20 0.30
RXFP1 Q9HBX9 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 SCHEMBL5603322 0.80
SCHEMBL5603352 0.79 DOT1L (0.34)
Hydrochloric Acid SCHEMBL5603537 0.79 ALDH1A1 (0.36) KDM4E
Hydrochloric Acid SCHEMBL5601369 0.78 CNR1 (0.31)
Hydrochloric Acid SCHEMBL5602820 0.75 PRKD3 (0.37) MAPT
Hydrochloric Acid SCHEMBL5602738 0.72 ALDH1A1 (0.34) KDM4EMAPT
Hydrochloric Acid SCHEMBL5602164 0.71
Hydrochloric Acid SCHEMBL5601613 0.69 CA1 (0.37) KDM4ESLC6A2MAPT
Fluoride Ion SCHEMBL5602392 0.68
Hydrochloric Acid SCHEMBL1685540 0.68 CYP1A2 (0.30)

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