Hydrochloric Acid

Hydrochloric Acid

SCHEMBL11516462

CCCC[n+]1c(C=CN(C)C)sc2ccccc21.[Cl-]

nearest known ligand 0.67

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
▸ INSR P06213 16/20 0.67
▸ APP P05067 1/20 0.47
▸ MAPT P10636 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ THRB P10828 2/20 0.44
▸ HTT P42858 2/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ MMP14 P50281 1/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ NSD2 O96028 1/20 0.44
▸ PKM P14618 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP3A4 P08684 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 SCHEMBL11516460 1.00 INSR (0.67) INSRAPPMAPTKMT2ATHRB
SCHEMBL16315975 0.81 INSR (0.71) INSRAPPMAPTKMT2ATHRB
SCHEMBL9910801 0.81 INSR (0.49) INSRAPPMAPTKMT2ATHRB
SCHEMBL10035963 0.80 INSR (1.00) INSRAPP
SCHEMBL13397621 0.80 INSR (1.00) INSRAPP
Hydrochloric Acid SCHEMBL11516278 0.80 INSR (0.49) INSRAPPMAPTKMT2ATHRB
Hydrochloric Acid SCHEMBL11515680 0.80 INSR (0.66) INSRAPPMAPTKMT2ATHRB
SCHEMBL11516289 0.80 INSR (0.60) INSRAPPMAPTKMT2ATHRB
SCHEMBL11516285 0.80 INSR (0.60) INSRAPPMAPTKMT2ATHRB
Hydrochloric Acid SCHEMBL11515678 0.80 INSR (0.66) INSRAPPMAPTKMT2ATHRB

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
US-4145537-A BENZOTHIAZOLIUM DYES BAYER AKTIENGESELLSCHAFT (DE) 1979-03-20 — — US disclosed
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