Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6557718

C1=CCC(C(c2ccccc2)C2c3ccccc3-c3ccccc32)=C1.[Cl-].[Cl-].[Zr+2]

nearest known ligand 0.40

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 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
KMT2A Q03164 1/20 0.40
ATM Q13315 1/20 0.40
CYP1A2 P05177 1/20 0.32
TSHR P16473 1/20 0.32

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 SCHEMBL7931312 0.84 MEN1 (0.32) MEN1POLBKMT2AATM
Hydrochloric Acid SCHEMBL7939937 0.84 DNMT1 (0.30)
Hydrochloric Acid SCHEMBL7930826 0.84 MEN1 (0.31) MEN1KMT2AATM
Hydrochloric Acid SCHEMBL9165907 0.83 MEN1 (0.33) MEN1POLBKMT2AATMCYP1A2
SCHEMBL7938778 0.80 SMN1; SMN2 (0.32) MEN1POLBKMT2AATMCYP1A2
SCHEMBL9168451 0.80 MEN1 (0.34) MEN1POLBKMT2AATMCYP1A2
Hydrochloric Acid SCHEMBL8674460 0.77 CYP1A2 (0.32) CYP1A2TSHR
Hydrochloric Acid SCHEMBL9168946 0.75 SIGMAR1 (0.30)
SCHEMBL3157929 0.75 MEN1 (0.52) MEN1POLBKMT2AATMCYP1A2
SCHEMBL8824255 0.73 MEN1 (0.37) MEN1POLBKMT2AATMCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0705851-B9 Catalyst systems and process for producing broad molecular weight distribution polyolefin CONOCOPHILLIPS CO (US) 2004-08-11 EP disclosed
EP-0705851-B1 Catalyst systems and process for producing broad molecular weight distribution polyolefin CONOCOPHILLIPS CO (US) 2004-01-21 EP disclosed
US-5594078-A BRIDGED FLUORENYL METALLOCENE CATALYST PHILLIPS PETROLEUM COMPANY (US) 1997-01-14 US disclosed
EP-0729978-A1 Polyethylene and method for production thereof PHILLIPS PETROLEUM COMPANY (US) 1996-09-04 EP disclosed
US-5534473-A METALLOCENES AND COCATALYST PHILLIPS PETROLEUM COMPANY (US) 1996-07-09 US disclosed
EP-0705851-A2 Catalyst systems and process for producing broad molecular weight distribution polyolefin PHILLIPS PETROLEUM COMPANY (US) 1996-04-10 EP disclosed
US-5420320-A Method for preparing cyclopentadienyl-type ligands and metallocene compounds PHILLIPS PETROLEUM COMPANY (US) 1995-05-30 US disclosed