Hydrochloric Acid

Hydrochloric Acid

SCHEMBL29672576

CCc1cccc(CC)c1-n1cc[n+](-c2c(CC)cccc2CC)c1.[Cl-]

nearest known ligand 0.34

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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 13)

geneUniProtsupporting neighboursconfidence
▸ GABRA1 P14867 3/20 0.34
▸ GABRB2 P47870 3/20 0.34
▸ CRHBP P24387 1/20 0.33
▸ CRHR2 Q13324 1/20 0.33
▸ ANPEP P15144 2/20 0.32
▸ DPP4 P27487 2/20 0.32
▸ NPEPPS P55786 2/20 0.31
▸ HTR1A P08908 1/20 0.30
▸ DRD2 P14416 1/20 0.30
▸ DRD4 P21917 1/20 0.30
▸ HTR2A P28223 1/20 0.30
▸ HTR2C P28335 1/20 0.30
▸ DRD3 P35462 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 SCHEMBL673215 0.84 DAO (0.31) —
SCHEMBL1751108 0.78 — —
SCHEMBL28045651 0.72 GABRA1 (0.46) GABRA1GABRB2CRHBPCRHR2ANPEP
Hydrochloric Acid SCHEMBL1737122 0.71 GABRA1 (0.41) GABRA1GABRB2HTR1ADRD2DRD4
Hydrochloric Acid SCHEMBL28358971 0.69 — —
SCHEMBL13397530 0.69 GABRA1 (0.43) GABRA1GABRB2HTR1ADRD2DRD4
SCHEMBL820123 0.68 MEN1 (0.31) —
SCHEMBL11077561 0.67 IDO1 (0.46) —
Hydrochloric Acid SCHEMBL28617768 0.67 NPEPPS (0.32) GABRA1GABRB2CRHBPCRHR2ANPEP
Hydrochloric Acid SCHEMBL28358970 0.66 — —

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
CN-113045533-B Synthetic method of cyclic carbonate 南京工业大学 2022-10-21 — — CN disclosed
CN-114644661-A Imidazole carbene iron complex and application thereof 北京服装学院 2022-06-21 — — CN disclosed
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