Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6897416

CC(C)=C1C=C([Zr+2])C=C(C2c3ccccc3-c3ccccc32)C1(C)C.[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 3)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.32
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL7719938 0.72 POLB (0.33) POLBMEN1KMT2A
Hydrochloric Acid SCHEMBL9246573 0.64 POLB (0.36) POLBKMT2A
Hydrochloric Acid SCHEMBL7902589 0.63 HTR2A (0.33) POLB
Hydrochloric Acid SCHEMBL3783189 0.62 HTR2A (0.35) POLB
SCHEMBL9285789 0.60 DRD2 (0.40) POLBMEN1KMT2A
Bromide SCHEMBL7205884 0.58 HTR2A (0.35) POLB
SCHEMBL29116619 0.58 HTR2A (0.50) MEN1KMT2A
SCHEMBL25171318 0.57 LMNA (0.54)
SCHEMBL70993 0.57 LMNA (0.54)
SCHEMBL29370508 0.57 LMNA (0.54)

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
EP-0874859-B1 OPEN-PENTADIENYL METALLOCENES, PRECURSORS THEREOF AND POLYMERIZATION CATALYSTS THEREFROM BASELL POLYOLEFINE GMBH (DE) 2004-03-17 EP disclosed