Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7182580

CCCCCCCCCCCCCCn1c(-c2cccc(-c3nc4ccccc4n3CCCCCCCCCCCCCC)n2)nc2ccccc21.[Cl-].[Cl-].[Cl-].[Co+3]

nearest known ligand 0.64

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 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.64
TLR8 Q9NR97 3/20 0.60
SMN1; SMN2 Q16637 3/20 0.55
GAA P10253 1/20 0.55
MAPT P10636 2/20 0.53
TDP1 Q9NUW8 1/20 0.53
HTT P42858 2/20 0.52
ALDH1A1 P00352 2/20 0.52
NPSR1 Q6W5P4 2/20 0.51
SAE1 Q9UBE0 1/20 0.51
UBA2 Q9UBT2 1/20 0.51
POLB P06746 1/20 0.47
CYP1A2 P05177 1/20 0.47
GLA P06280 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47

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 SCHEMBL7176646 1.00 TP53 (0.64) TP53TLR8SMN1; SMN2GAAMAPT
Hydrochloric Acid SCHEMBL7178203 1.00 TP53 (0.64) TP53TLR8SMN1; SMN2GAAMAPT
Hydrochloric Acid SCHEMBL7177476 1.00 TP53 (0.64) TP53TLR8SMN1; SMN2GAAMAPT
Hydrochloric Acid SCHEMBL7173233 1.00 TP53 (0.64) TP53TLR8SMN1; SMN2GAAMAPT
Hydrochloric Acid SCHEMBL7177548 1.00 TP53 (0.64) TP53TLR8SMN1; SMN2GAAMAPT
Hydrochloric Acid SCHEMBL7175528 1.00 TP53 (0.64) TP53TLR8SMN1; SMN2GAAMAPT
Hydrochloric Acid SCHEMBL7172205 0.99 TP53 (0.66) TP53TLR8SMN1; SMN2GAAMAPT
Hydrochloric Acid SCHEMBL7181263 0.97 TP53 (0.64) TP53TLR8SMN1; SMN2GAAMAPT
Hydrochloric Acid SCHEMBL7173543 0.97 TP53 (0.64) TP53TLR8SMN1; SMN2GAAMAPT
Hydrochloric Acid SCHEMBL7176268 0.97 TP53 (0.64) TP53TLR8SMN1; SMN2GAAMAPT

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