Hydrochloric Acid

Hydrochloric Acid

SCHEMBL18689999

CC(C)(C)c1ccc(C(c2ccc(C(C)(C)C)cc2)=[Hf+2](C2=CC=CC2)C2c3cc(C(C)(C)C)ccc3-c3ccc(C(C)(C)C)cc32)cc1.[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 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
MAPT P10636 1/20 0.32
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA9 Q16790 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 SCHEMBL18420561 0.94 NPC1 (0.32) MAPTCA12CA1CA9
Hydrochloric Acid SCHEMBL18689958 0.93 POLB (0.33) MEN1KMT2A
Hydrochloric Acid SCHEMBL18420191 0.93
Hydrochloric Acid SCHEMBL5079597 0.93 NPC1 (0.33)
Hydrochloric Acid SCHEMBL18689962 0.92
Hydrochloric Acid SCHEMBL18420297 0.92 CA9 (0.31) MEN1KMT2AMAPTCA12CA1
Hydrochloric Acid SCHEMBL1643823 0.90
Hydrochloric Acid SCHEMBL18689967 0.89
Hydrochloric Acid SCHEMBL18689974 0.88 NPC1 (0.30)
Hydrochloric Acid SCHEMBL18689949 0.88 PLK1 (0.34)

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-9771448-B2 Olefin-based resin, method for producing same and propylene-based resin composition MITSUI CHEMICALS, INC. (JP) 2017-09-26 US disclosed
US-20170096514-A1 OLEFIN-BASED RESIN, METHOD FOR PRODUCING SAME AND PROPYLENE-BASED RESIN COMPOSITION MITSUI CHEMICALS, INC. (JP) 2017-04-06 US disclosed