Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3321676

CC(=Nc1c(C)cc(C)cc1Cl)c1cccc(C(C)=Nc2c(C)cc(C)cc2Cl)n1.CC(=Nc1c(C)cccc1Cl)c1cccc(C(C)=Nc2c(C)cccc2Cl)n1.[Cl-].[Cl-].[Cl-].[Cl-].[Fe+2].[Fe+2]

nearest known ligand 0.34

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 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
HSP90AA1 P07900 1/20 0.33
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33
RAPGEF4 Q8WZA2 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 SCHEMBL20703698 0.96 MEN1 (0.33) MEN1HSP90AA1KMT2AATMRAPGEF4
Hydrochloric Acid SCHEMBL28406677 0.96 MEN1 (0.33) MEN1HSP90AA1KMT2AATMRAPGEF4
Hydrochloric Acid SCHEMBL1258347 0.95 KMT2A (0.32) MEN1HSP90AA1KMT2ARAPGEF4
Hydrochloric Acid SCHEMBL3625830 0.95 KMT2A (0.32) MEN1HSP90AA1KMT2ARAPGEF4
SCHEMBL699809 0.93 MEN1 (0.35) MEN1HSP90AA1KMT2AATMRAPGEF4
SCHEMBL699810 0.93 MEN1 (0.35) MEN1HSP90AA1KMT2AATMRAPGEF4
SCHEMBL4515332 0.93 MEN1 (0.35) MEN1HSP90AA1KMT2AATMRAPGEF4
SCHEMBL4515328 0.93 MEN1 (0.35) MEN1HSP90AA1KMT2AATMRAPGEF4
SCHEMBL31013359 0.93 KMT2A (0.33) MEN1HSP90AA1KMT2AATMRAPGEF4
Hydrochloric Acid SCHEMBL3625061 0.92 KMT2A (0.32) MEN1HSP90AA1KMT2ARAPGEF4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1943281-B1 HYBRID CATALYST SYSTEMS SUPPORTED ON MAGNESIUM HALIDE BASELL POLYOLEFINE GMBH (DE) 2017-09-20 EP disclosed
US-7723448-B2 Hybrid catalyst systems supported on magnesium halide BASELL POLYOLEFINE GMBH (DE) 2010-05-25 US disclosed
US-20090118445-A1 Hybrid Catalyst Systems Supported On Magnesium Halide BASELL POLYOLOLINE GMBH (DE) 2009-05-07 US disclosed