Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7185494

Cc1cc(C=Nc2c(C)cccc2C)nc(C=Nc2c(C)cccc2C)c1.[Cl-].[Cl-].[Fe+2]

nearest known ligand 0.36

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 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
HSP90AA1 P07900 1/20 0.34
KMT2A Q03164 1/20 0.34
ATM Q13315 1/20 0.34
NPSR1 Q6W5P4 2/20 0.33
KDM4E B2RXH2 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
CYP1A2 P05177 2/20 0.32
NPC1 O15118 1/20 0.32
CASP3 P42574 1/20 0.32
SENP8 Q96LD8 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32
CYP2A6 P11509 1/20 0.32
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.30
NR4A1 P22736 1/20 0.30

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 SCHEMBL7182026 0.97 MEN1 (0.34) MEN1HSP90AA1KMT2AATMNPSR1
Hydrochloric Acid SCHEMBL7171560 0.97 MEN1 (0.34) MEN1HSP90AA1KMT2AATMNPSR1
Hydrochloric Acid SCHEMBL7181479 0.97 MEN1 (0.34) MEN1HSP90AA1KMT2AATMNPSR1
Hydrochloric Acid SCHEMBL7179338 0.97 MEN1 (0.34) MEN1HSP90AA1KMT2AATMNPSR1
Hydrochloric Acid SCHEMBL7177603 0.97 MEN1 (0.34) MEN1HSP90AA1KMT2AATMNPSR1
SCHEMBL6910655 0.96 MEN1 (0.36) MEN1HSP90AA1KMT2AATMNPSR1
SCHEMBL6910656 0.96 MEN1 (0.36) MEN1HSP90AA1KMT2AATMNPSR1
Hydrochloric Acid SCHEMBL7182528 0.87 ALDH1A1 (0.35) NPSR1MAPTHTTALDH1A1
Hydrochloric Acid SCHEMBL7179444 0.87 NR4A1 (0.36) MEN1HSP90AA1KMT2AATMNPSR1
SCHEMBL6915044 0.87 MAOA (0.42) MEN1HSP90AA1KMT2AATMNPSR1

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