Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7173148

CC1(C)COC(c2cccc(C3=NC(C)(C)CO3)n2)=N1.[Cl-].[Cl-].[Co+2]

nearest known ligand 0.93

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 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.93
HRH3 Q9Y5N1 3/20 0.39
ALDH1A1 P00352 2/20 0.38
HTT P42858 2/20 0.38
ATM Q13315 2/20 0.38
HPGD P15428 1/20 0.38
MEN1 O00255 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
CYP2D6 P10635 1/20 0.37
JAK2 O60674 1/20 0.35
TYK2 P29597 1/20 0.35

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 SCHEMBL7171435 0.96 KDM4E (0.93) KDM4EHRH3ALDH1A1HTTATM
Hydrochloric Acid SCHEMBL7175648 0.96 KDM4E (0.93) KDM4EHRH3ALDH1A1HTTATM
Hydrochloric Acid SCHEMBL7176715 0.96 KDM4E (0.93) KDM4EHRH3ALDH1A1HTTATM
Hydrochloric Acid SCHEMBL7174211 0.96 KDM4E (0.93) KDM4EHRH3ALDH1A1HTTATM
Hydrochloric Acid SCHEMBL7171692 0.96 KDM4E (0.93) KDM4EHRH3ALDH1A1HTTATM
Hydrochloric Acid SCHEMBL7181592 0.96 KDM4E (0.93) KDM4EHRH3ALDH1A1HTTATM
SCHEMBL8855999 0.96 KDM4E (1.00) KDM4EHRH3ALDH1A1HTTATM
SCHEMBL20410986 0.90 KDM4E (0.87) KDM4EHRH3ALDH1A1HTTATM
SCHEMBL20410871 0.88 KDM4E (0.84) KDM4EHRH3ALDH1A1HTTATM
SCHEMBL758966 0.87 KDM4E (0.81) KDM4EHRH3ALDH1A1HTTATM

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