Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7173741

Cc1ccc(N=Cc2cc(Cl)cc(C=Nc3ccc(C)cc3)n2)cc1.[Cl-].[Cl-].[Cl-].[Nd+3]

nearest known ligand 0.43

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 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.43
KMT2A Q03164 8/20 0.43
MEN1 O00255 7/20 0.43
NR4A1 P22736 1/20 0.40
ALDH1A1 P00352 6/20 0.39
CYP2D6 P10635 2/20 0.37
CYP2C9 P11712 2/20 0.37
HPGD P15428 3/20 0.37
KDM4E B2RXH2 2/20 0.37
GAA P10253 2/20 0.37
USP2 O75604 1/20 0.37
THRB P10828 1/20 0.37
HTT P42858 1/20 0.37
PTGS2 P35354 3/20 0.36
PTGS1 P23219 1/20 0.36
CA12 O43570 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
MAOA P21397 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36

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 SCHEMBL7177501 0.97 MAPT (0.43) MAPTKMT2AMEN1NR4A1ALDH1A1
Hydrochloric Acid SCHEMBL7178927 0.97 MAPT (0.43) MAPTKMT2AMEN1NR4A1ALDH1A1
Hydrochloric Acid SCHEMBL7181632 0.97 MAPT (0.43) MAPTKMT2AMEN1NR4A1ALDH1A1
Hydrochloric Acid SCHEMBL7173224 0.97 MAPT (0.43) MAPTKMT2AMEN1NR4A1ALDH1A1
Hydrochloric Acid SCHEMBL7185097 0.97 MAPT (0.43) MAPTKMT2AMEN1NR4A1ALDH1A1
Hydrochloric Acid SCHEMBL7182221 0.97 MAPT (0.43) MAPTKMT2AMEN1NR4A1ALDH1A1
Hydrochloric Acid SCHEMBL7177162 0.88 NR4A1 (0.43) MAPTKMT2AMEN1NR4A1ALDH1A1
Hydrochloric Acid SCHEMBL7174493 0.84 NR4A1 (0.43) MAPTKMT2AMEN1NR4A1ALDH1A1
Hydrochloric Acid SCHEMBL7180426 0.84 NR4A1 (0.43) MAPTKMT2AMEN1NR4A1ALDH1A1
Hydrochloric Acid SCHEMBL7183402 0.84 NR4A1 (0.43) MAPTKMT2AMEN1NR4A1ALDH1A1

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
EP-1367069-A1 Process for homo-or copolymerization of conjugated diens DOW GLOBAL TECHNOLOGIES INC. (US) 2003-12-03 EP disclosed