Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7180460

CCN(CC)Cn1c(-c2cccc(-c3nc4ccccc4n3CN(CC)CC)n2)nc2ccccc21.[Cl-].[Cl-].[Fe+2]

nearest known ligand 0.50

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
PKM P14618 1/20 0.50
KDM4E B2RXH2 6/20 0.49
ALDH1A1 P00352 6/20 0.49
HPGD P15428 6/20 0.49
HSD17B10 Q99714 3/20 0.49
TSHR P16473 1/20 0.49
HTT P42858 4/20 0.45
DRD2 P14416 5/20 0.43
DRD3 P35462 5/20 0.43
MAPT P10636 3/20 0.43
CYP1A2 P05177 2/20 0.43
ATM Q13315 1/20 0.43
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
RAB9A P51151 1/20 0.43
GFER P55789 1/20 0.43
KMT2A Q03164 1/20 0.43

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 SCHEMBL7172565 0.97 PKM (0.50) PKMKDM4EALDH1A1HPGDHSD17B10
Hydrochloric Acid SCHEMBL7172210 0.97 PKM (0.50) PKMKDM4EALDH1A1HPGDHSD17B10
Hydrochloric Acid SCHEMBL7173462 0.97 PKM (0.50) PKMKDM4EALDH1A1HPGDHSD17B10
Hydrochloric Acid SCHEMBL7173204 0.97 PKM (0.50) PKMKDM4EALDH1A1HPGDHSD17B10
Hydrochloric Acid SCHEMBL7177588 0.97 PKM (0.50) PKMKDM4EALDH1A1HPGDHSD17B10
Hydrochloric Acid SCHEMBL7173919 0.97 PKM (0.50) PKMKDM4EALDH1A1HPGDHSD17B10
Hydrochloric Acid SCHEMBL7173138 0.86 PKM (0.65) PKMKDM4EALDH1A1HPGDHSD17B10
Hydrochloric Acid SCHEMBL7175894 0.86 ALDH1A1 (0.45) KDM4EALDH1A1HPGDHSD17B10TSHR
Hydrochloric Acid SCHEMBL7176647 0.84 ALDH1A1 (0.57) PKMKDM4EALDH1A1HPGDHSD17B10
Hydrochloric Acid SCHEMBL7176318 0.84 PKM (0.65) PKMKDM4EALDH1A1HPGDHSD17B10

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