Hydrochloric Acid

Hydrochloric Acid

SCHEMBL673708

CC(C)=[Zr+2](C1=CC(C)(C23CC4CC(CC(C4)C2)C3)C=C1)c1cccc2c1Cc1ccccc1-2.[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 2)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32

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 SCHEMBL674703 0.90
Hydrochloric Acid SCHEMBL676151 0.82
Hydrochloric Acid SCHEMBL674867 0.82
Hydrochloric Acid SCHEMBL675086 0.79
Hydrochloric Acid SCHEMBL673153 0.74 PGR (0.32)
Hydrochloric Acid SCHEMBL3124487 0.74 NPC1 (0.49) NPC1RAB9A
Hydrochloric Acid SCHEMBL2839238 0.73 PGR (0.32) NPC1RAB9A
Hydrochloric Acid SCHEMBL675194 0.73
Hydrochloric Acid SCHEMBL674530 0.72 NPC1 (0.32) NPC1RAB9A
Hydrochloric Acid SCHEMBL673498 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8063146-B2 Thermoplastic elastomer composition MITSUI CHEMICALS, INC. (JP) 2011-11-22 US disclosed
US-20100120933-A1 THERMOPLASTIC ELASTOMER COMPOSITION MITSUI CHEMICALS, INC. (JP) 2010-05-13 US disclosed