Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7178409

Cc1cc(C)c(N=Cc2cccc(C=Nc3c(C)cc(C)cc3C)n2)c(C)c1.[Cl-].[Cl-].[Co+2]

nearest known ligand 0.38

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 3/20 0.37
HTT P42858 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
NR4A1 P22736 1/20 0.37
ALDH1A1 P00352 4/20 0.36
MAOA P21397 2/20 0.36
ALOX15 P16050 3/20 0.35
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
MAOB P27338 1/20 0.33
GAA P10253 2/20 0.33
CYP2A6 P11509 1/20 0.32
LMNA P02545 2/20 0.32
KDM4E B2RXH2 2/20 0.32
HPGD P15428 2/20 0.32
HSD17B10 Q99714 2/20 0.32
CTH P32929 1/20 0.32
POLB P06746 1/20 0.32
THRB P10828 1/20 0.32

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 SCHEMBL7173124 0.97 MAPT (0.37) MAPTHTTNPSR1NR4A1ALDH1A1
Hydrochloric Acid SCHEMBL7173174 0.97 MAPT (0.37) MAPTHTTNPSR1NR4A1ALDH1A1
Hydrochloric Acid SCHEMBL7171324 0.97 MAPT (0.37) MAPTHTTNPSR1NR4A1ALDH1A1
Hydrochloric Acid SCHEMBL7184009 0.97 MAPT (0.37) MAPTHTTNPSR1NR4A1ALDH1A1
Hydrochloric Acid SCHEMBL7178917 0.97 MAPT (0.37) MAPTHTTNPSR1NR4A1ALDH1A1
Hydrochloric Acid SCHEMBL7180914 0.97 MAPT (0.37) MAPTHTTNPSR1NR4A1ALDH1A1
SCHEMBL5588346 0.96 ALDH1A1 (0.38) MAPTHTTNPSR1NR4A1ALDH1A1
SCHEMBL5588352 0.96 ALDH1A1 (0.38) MAPTHTTNPSR1NR4A1ALDH1A1
SCHEMBL5589321 0.95 ALDH1A1 (0.37) MAPTHTTNPSR1NR4A1ALDH1A1
SCHEMBL25429946 0.89 MAPT (0.40) MAPTHTTNPSR1NR4A1ALDH1A1

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