Hydrochloric Acid

Hydrochloric Acid

SCHEMBL2861546

CC1=Cc2ccccc2C1[Zr+2](=C(c1ccccc1)c1ccccc1)C1c2cc(C(C)(C)C)ccc2-c2ccc(C(C)(C)C)cc21.[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 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.32
NPC1 O15118 2/20 0.30
ALDH1A1 P00352 2/20 0.30
CASP3 P42574 2/20 0.30
RAB9A P51151 2/20 0.30
SENP8 Q96LD8 2/20 0.30
SENP7 Q9BQF6 2/20 0.30
SENP6 Q9GZR1 2/20 0.30
PLA2G1B P04054 1/20 0.30
NFKB1 P19838 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
ATG4B Q9Y4P1 1/20 0.30
GLA P06280 1/20 0.30
MAPK1 P28482 1/20 0.30
HTT P42858 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 SCHEMBL2866640 0.90 CNR1 (0.33)
Hydrochloric Acid SCHEMBL2868386 0.90 CNR1 (0.31)
Hydrochloric Acid SCHEMBL2863938 0.87 LMNA (0.31) LMNA
Hydrochloric Acid SCHEMBL565518 0.87
Hydrochloric Acid SCHEMBL2866783 0.86 LMNA (0.33) LMNANPC1RAB9A
Hydrochloric Acid SCHEMBL2860769 0.86 ALDH1A1 (0.32) LMNAALDH1A1
Hydrochloric Acid SCHEMBL2868431 0.84 LMNA (0.35) LMNA
Hydrochloric Acid SCHEMBL2863635 0.84 CNR1 (0.32)
Hydrochloric Acid SCHEMBL31024191 0.83 LMNA (0.39) LMNA
Hydrochloric Acid SCHEMBL437861 0.83 LMNA (0.39) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1964860-B1 ETHYLENE POLYMER, CATALYST FOR PRODUCTION OF ETHYLENE POLYMER, AND PROCESS FOR PRODUCTION OF ETHYLENE POLYMER TOSOH CORP (JP) 2017-07-05 EP disclosed
US-7838611-B2 Ethylene polymer, catalyst for ethylene polymer production, and method for producing ethylene polymer TOSOH CORPORATION (JP) 2010-11-23 US disclosed
US-7678866-B2 Polyethylene composition and process for producing same TOSOH CORPORATION (JP) 2010-03-16 US disclosed
US-20090137755-A1 ETHYLENE POLYMER, CATALYST FOR ETHYLENE POLYMER PRODUCTION, AND METHOD FOR PRODUCING ETHYLENE POLYMER TOSOH CORPORATION (JP) 2009-05-28 US disclosed
EP-1473323-A1 Polyethylene composition and process for producing same Tosoh Corporation (JP) 2004-11-03 EP disclosed
US-20040214953-A1 Polyethylene composition and process for producing same TOSOH CORPORATION 2004-10-28 US disclosed