Hydrochloric Acid

Hydrochloric Acid

SCHEMBL2867898

CC1=CC([Zr+2](=C(c2ccccc2)c2ccccc2)C2c3cc(C)ccc3-c3ccc(C)cc32)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 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
LMNA P02545 1/20 0.32
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
PPIA P62937 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
CRHBP P24387 1/20 0.30
CYP2C19 P33261 1/20 0.30
ATM Q13315 1/20 0.30
CRHR2 Q13324 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
PGR P06401 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 SCHEMBL2863292 0.95 MEN1 (0.32) MEN1KMT2ALMNANPC1RAB9A
Hydrochloric Acid SCHEMBL2861627 0.95 NPC1 (0.32) MEN1KMT2ANPC1RAB9ACYP1A2
Hydrochloric Acid SCHEMBL2871022 0.93 MEN1 (0.32) MEN1KMT2ANPC1RAB9APPIA
Hydrochloric Acid SCHEMBL2870400 0.90 PPIA (0.34) MEN1KMT2ALMNANPC1RAB9A
Hydrochloric Acid SCHEMBL2861167 0.90 PGR (0.31) MEN1KMT2ALMNAPGR
Hydrochloric Acid SCHEMBL2857571 0.87 CNR2 (0.30) MEN1KMT2ANPC1RAB9A
Hydrochloric Acid SCHEMBL2868909 0.87 NPC1 (0.32) LMNANPC1RAB9A
Hydrochloric Acid SCHEMBL2864149 0.87 CNR1 (0.31) LMNA
Hydrochloric Acid SCHEMBL2861422 0.86 HTR7 (0.31)
Hydrochloric Acid SCHEMBL2860259 0.86 HTR7 (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 7 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
EP-1473323-B1 Polyethylene composition and process for producing same TOSOH CORP (JP) 2016-04-27 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-1964860-A1 ETHYLENE POLYMER, CATALYST FOR PRODUCTION OF ETHYLENE POLYMER, AND PROCESS FOR PRODUCTION OF ETHYLENE POLYMER Tosoh Corporation (JP) 2008-09-03 EP disclosed
US-20040214953-A1 Polyethylene composition and process for producing same TOSOH CORPORATION 2004-10-28 US disclosed