Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6553574

CC1=Cc2c(-c3ccccc3)cccc2C1[Zr+2]C1c2ccccc2-c2ccccc21.[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 4)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 1/20 0.32
CD274 Q9NZQ7 1/20 0.32
CHRNB2 P17787 1/20 0.31
CHRNA4 P43681 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 SCHEMBL2525982 0.95 PDCD1 (0.34) PDCD1CD274CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL29564499 0.95 PDCD1 (0.34) PDCD1CD274CHRNB2CHRNA4
Fluoride Ion SCHEMBL7636064 0.92 PDCD1 (0.34) PDCD1CD274CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL21980378 0.89 PDCD1 (0.33) PDCD1CD274
Hydrochloric Acid SCHEMBL8633266 0.89 PDCD1 (0.30) PDCD1CD274
Hydrochloric Acid SCHEMBL7143627 0.87
Hydrochloric Acid SCHEMBL7935429 0.86 ADRA2A (0.33) CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL8628885 0.85 TNF (0.35) PDCD1CD274CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL8630711 0.85 PDCD1 (0.31) PDCD1CD274
Hydrochloric Acid SCHEMBL8633278 0.85 CA12 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1077215-B1 Asymmetric silicon-bridged metallocenes useful as catalysts in the polymerization of a-olefins, process for their preparation and use of said metallocenes for the polymerization of a-olefins SOLVAY (BE) 2004-02-18 EP disclosed
US-6355747-B1 FOR POLYMERIZATION OF PROPYLENE TO PRODUCE ISOTACTIC POLYPROPYLENE SOLVAY POLYOLEFINS EUROPE-BELGIUM (BE) 2002-03-12 US disclosed
EP-1077215-A1 Asymmetric silicon-bridged metallocenes useful as catalysts in the polymerization of a-olefins, process for their preparation and use of said metallocenes for the polymerization of a-olefins SOLVAY POLYOLEFINS EUROPE - BELGIUM (Société Anonyme) (BE) 2001-02-21 EP disclosed
EP-0754698-A2 An olefin polymerization catalyst and a process for preparing olefin polymer MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1997-01-22 EP disclosed