Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7770339

C(c1ccccc1)=P(C1CCCCC1)(C1CCCCC1)C1CCCCC1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.[Cl-].[Cl-].[Ru+2]

nearest known ligand 0.33

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 6)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
HSP90AA1 P07900 2/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KDM4E B2RXH2 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 SCHEMBL5185627 0.95 POLB (0.33) POLBGAAHSP90AA1MAPK1SMN1; SMN2
SCHEMBL1661802 0.87 GAA (0.40) POLBGAAHSP90AA1MAPK1SMN1; SMN2
SCHEMBL3929573 0.85 GAA (0.39) POLBGAAHSP90AA1MAPK1SMN1; SMN2
SCHEMBL1578848 0.85 GAA (0.41) POLBGAAHSP90AA1MAPK1SMN1; SMN2
SCHEMBL29712141 0.75 POLB (0.33) POLBGAAHSP90AA1MAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL175377 0.75 POLB (0.37) POLBGAAHSP90AA1MAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL4542337 0.75 POLB (0.37) POLBGAAHSP90AA1MAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL2064723 0.75 POLB (0.37) POLBGAAHSP90AA1MAPK1SMN1; SMN2
SCHEMBL29712098 0.74 POLB (0.32) POLBGAAHSP90AA1MAPK1SMN1; SMN2
SCHEMBL2868301 0.73 GAA (0.38) POLBGAAHSP90AA1MAPK1SMN1; SMN2

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-1124686-A1 REGIO-REGULAR FUNCTIONALIZED POLYMERIC PACKAGING MATERIAL Cryovac, Inc. (US) 2001-08-22 EP disclosed
US-6203923-B1 POLYMERS WITH HYDROXY, CARBOXY ACID, CARBOXY ESTER, ACETATE. AMIDE, NITRILE OR CARBONYL CRYOVAC, INC. 2001-03-20 US disclosed
WO-2000018579-A1 REGIO-REGULAR FUNCTIONALIZED POLYMERIC PACKAGING MATERIAL CRYOVAC, INC. (US) 2000-04-06 WO disclosed