Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7185501

CC(=Nc1c(C(C)C)cc(C(C)C)cc1C(C)C)c1cccc(C(C)=Nc2c(C(C)C)cc(C(C)C)cc2C(C)C)n1.[Cl-].[Cl-].[Cl-].[V+3]

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 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 known ✓ P23975 1/20 0.31
GABRA1 P14867 3/20 0.34
GABRB2 P47870 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
FABP3 P05413 2/20 0.33
FABP4 P15090 2/20 0.33
GAA P10253 2/20 0.33
FABP5 Q01469 1/20 0.33
GABRG2 P18507 2/20 0.32
GABRB3 P28472 2/20 0.32
PDE4B Q07343 1/20 0.31
FAAH O00519 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
GABRB1 P18505 1/20 0.31

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 SCHEMBL7178521 0.97 GABRA1 (0.34) GABRA1GABRB2TDP1FABP3FABP4
Hydrochloric Acid SCHEMBL7176920 0.97 GABRA1 (0.34) GABRA1GABRB2TDP1FABP3FABP4
Hydrochloric Acid SCHEMBL7182194 0.97 GABRA1 (0.34) GABRA1GABRB2TDP1FABP3FABP4
Hydrochloric Acid SCHEMBL7180516 0.97 GABRA1 (0.34) GABRA1GABRB2TDP1FABP3FABP4
Hydrochloric Acid SCHEMBL7172124 0.97 GABRA1 (0.34) GABRA1GABRB2TDP1FABP3FABP4
Hydrochloric Acid SCHEMBL7179086 0.97 GABRA1 (0.34) GABRA1GABRB2TDP1FABP3FABP4
SCHEMBL16077911 0.97 GABRA1 (0.36) GABRA1GABRB2TDP1FABP3FABP4
Hydrochloric Acid SCHEMBL7174370 0.88 GABRA1 (0.32) GABRA1GABRB2GABRG2GABRB3FAAH
Hydrochloric Acid SCHEMBL7175760 0.88 GABRA1 (0.39) GABRA1GABRB2TDP1GABRG2GABRB3
Hydrochloric Acid SCHEMBL7180672 0.85 GABRA1 (0.32) GABRA1GABRB2GABRG2GABRB3FAAH

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