Hydrochloric Acid

Hydrochloric Acid

SCHEMBL2862740

Cc1ccc2c(c1)C([Zr+2](=C(c1ccccc1)c1ccccc1)C1C=Cc3c(-c4ccccc4)cccc31)c1cc(C)ccc1-2.[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
CNR2 P34972 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
NPC1 O15118 1/20 0.32
TP53 P04637 1/20 0.32
RAB9A P51151 1/20 0.32
PSMB5 P28074 1/20 0.30
PPIA P62937 1/20 0.30
CNR1 P21554 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
RECQL P46063 1/20 0.30
NPSR1 Q6W5P4 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 SCHEMBL2861818 0.90
Hydrochloric Acid SCHEMBL2866598 0.89
Hydrochloric Acid SCHEMBL2868340 0.86 NPC1 (0.33) NPC1RAB9AALDH1A1LMNAMAPT
Hydrochloric Acid SCHEMBL2855740 0.86 NPC1 (0.31) CNR2NPC1RAB9ACNR1ALDH1A1
Hydrochloric Acid SCHEMBL30576293 0.86 NPC1 (0.31) CNR2NPC1RAB9ACNR1ALDH1A1
Hydrochloric Acid SCHEMBL2869824 0.85
Hydrochloric Acid SCHEMBL2872411 0.85 CNR2 (0.31) CNR2LMNA
Hydrochloric Acid SCHEMBL2872420 0.83 CNR2 (0.32) CNR2
Hydrochloric Acid SCHEMBL2864401 0.83
Hydrochloric Acid SCHEMBL2861109 0.82 LMNA (0.33) MEN1KMT2ALMNA

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-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-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