Hydrochloric Acid

Hydrochloric Acid

SCHEMBL12825804

[Cl-].[Cl-].[Cl-].[Ti+3]C1=CCC([Si](c2cc(Cc3ccccc3)cc(Cc3ccccc3)c2)(c2cc(Cc3ccccc3)cc(Cc3ccccc3)c2)c2cc(Cc3ccccc3)cc(Cc3ccccc3)c2)=C1c1ccccc1

nearest known ligand 0.35

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 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CALM1 P0DP23 1/20 0.32
PTPN1 P18031 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 SCHEMBL10317489 0.87 NISCH (0.30)
Hydrochloric Acid SCHEMBL10320017 0.83 NOTUM (0.30)
Hydrochloric Acid SCHEMBL10321193 0.81 HSD11B1 (0.36) TDP1L3MBTL1
Hydrochloric Acid SCHEMBL10317704 0.80 ADORA2A (0.35)
Hydrochloric Acid SCHEMBL12816089 0.79 ALDH1A1 (0.35) ALDH1A1RAB9ASMN1; SMN2TDP1L3MBTL1
Hydrochloric Acid SCHEMBL10320141 0.77 RXRA (0.32)
Hydrochloric Acid SCHEMBL10317722 0.76 METAP2 (0.32)
Hydrochloric Acid SCHEMBL11897013 0.76 RAB9A (0.38) ALDH1A1RAB9ASMN1; SMN2L3MBTL1
Hydrochloric Acid SCHEMBL10319489 0.75 TP53 (0.33)
Hydrochloric Acid SCHEMBL10318986 0.75 CALM1 (0.33) CALM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012133919-A1 PROCESS FOR PRODUCING CATALYST FOR PRODUCING ETHYLENIC POLYMER, CATALYST FOR PRODUCING ETHYLENIC POLYMER AND PROCESS FOR PRODUCING ETHYLENIC POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-04 WO disclosed