Hydrochloric Acid

Hydrochloric Acid

SCHEMBL12815488

CC(C)C1=CCC([Ti+3])=C1[Si](c1cc(Cc2ccccc2)cc(Cc2ccccc2)c1)(c1cc(Cc2ccccc2)cc(Cc2ccccc2)c1)c1cc(Cc2ccccc2)cc(Cc2ccccc2)c1.[Cl-].[Cl-].[Cl-]

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 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CNR2 P34972 1/20 0.30
GPR55 Q9Y2T6 1/20 0.30
CALM1 P0DP23 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 SCHEMBL12816282 0.89
Hydrochloric Acid SCHEMBL12816133 0.83
Hydrochloric Acid SCHEMBL12828864 0.82 ALDH1A1 (0.31) ALDH1A1RAB9ASMN1; SMN2TDP1L3MBTL1
Hydrochloric Acid SCHEMBL12816114 0.82 CALM1 (0.33) ALDH1A1RAB9ASMN1; SMN2TDP1L3MBTL1
Hydrochloric Acid SCHEMBL12815381 0.80 HPGD (0.33) CALM1
Hydrochloric Acid SCHEMBL12815641 0.80 ALDH1A1 (0.35) ALDH1A1RAB9ASMN1; SMN2TDP1L3MBTL1
Hydrochloric Acid SCHEMBL12816365 0.77 PDE4A (0.30)
Hydrochloric Acid SCHEMBL12816752 0.75 TSHR (0.31)
Hydrochloric Acid SCHEMBL12816452 0.74 CALM1 (0.33) ALDH1A1RAB9ASMN1; SMN2TDP1L3MBTL1
Hydrochloric Acid SCHEMBL12816223 0.74 KDM4E (0.30) ALDH1A1SMN1; SMN2TDP1

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-2012133936-A1 CATALYST FOR PRODUCING ETHYLENE-BASED POLYMER AND METHOD FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-04 WO disclosed