Hydrochloric Acid

Hydrochloric Acid

SCHEMBL8599348

CC1=[N+](C)C=CC(=NNC(=O)N(c2ccccc2)c2ccccc2)C1O.[Cl-]

nearest known ligand 0.35

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 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
LMNA P02545 1/20 0.35
THRB P10828 1/20 0.35
HPGD P15428 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NPSR1 Q6W5P4 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
PTGIR P43119 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 SCHEMBL8597511 0.68 MEN1 (0.33) MEN1KMT2ALMNATHRBHPGD
Hydrochloric Acid SCHEMBL8599347 0.64 LMNA (0.36) MEN1KMT2ALMNATHRBHPGD
SCHEMBL12914594 0.63 NPSR1 (0.61) MEN1KMT2ALMNATHRBHPGD
SCHEMBL9004614 0.62 MAPT (0.59) MEN1KMT2ALMNATHRBL3MBTL1
SCHEMBL27734422 0.61 NPSR1 (0.52) MEN1KMT2ALMNATHRBHPGD
SCHEMBL29941486 0.60 NPSR1 (0.47) MEN1KMT2ALMNAL3MBTL1NPSR1
SCHEMBL900147 0.60 NPSR1 (0.56) MEN1KMT2AHPGDL3MBTL1NPSR1
SCHEMBL264029 0.60 NPSR1 (0.56) MEN1KMT2ALMNATHRBHPGD
SCHEMBL20568739 0.59 POLB (0.51) MEN1KMT2ALMNAL3MBTL1NPSR1
SCHEMBL1382899 0.59 MEN1 (0.67) MEN1KMT2AHPGDNPSR1CA1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5726314-A ACETYLCHOLINESTERASE INHIBITORS AS NERVE AGENT ANTIDOTES GEORGIA TECH RESEARCH CORP. (US) 1998-03-10 US disclosed
US-5714615-A ACETYLCHOLINESTERASE ENZYME INHIBITOR, STIMULATE NICOTINIC RECEPTORS IN CENTRAL NERVOUS SYSTEM GEORGIA TECH RESEARCH CORPORATION (US) 1998-02-03 US disclosed