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Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL8085239

N.N.Nc1ccc2cccc3c2c1C=CC3N

nearest known ligand 0.32

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.32
▸ CYP1A1 P04798 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ CYP1B1 Q16678 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32

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
SCHEMBL5489157 0.98 ALDH1A1 (0.33) ALDH1A1CYP1A1CYP1A2CYP3A4HPGD
SCHEMBL29012925 0.97 ALDH1A1 (0.32) ALDH1A1CYP1A1CYP1A2CYP3A4HPGD
Hydroxyamine SCHEMBL29210814 0.95 ALDH1A1 (0.31) ALDH1A1CYP1A1CYP1A2CYP3A4HPGD
SCHEMBL900144 0.94 ALDH1A1 (0.30) ALDH1A1CYP1A1CYP1A2CYP3A4HPGD
Acetonitrile SCHEMBL29013766 0.90 — —
Alcohol SCHEMBL29044093 0.90 — —
Hydrochloric Acid SCHEMBL28198085 0.84 CYP3A4 (0.33) ALDH1A1CYP3A4HSD17B10
SCHEMBL10870531 0.80 ALDH1A1 (0.32) ALDH1A1CYP1A1CYP1A2CYP3A4HPGD
SCHEMBL28097865 0.78 DHFR (0.36) ALDH1A1HSD17B10
SCHEMBL5534355 0.76 — —

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-0752102-B1 IMMUNOENZYMATIC CONJUGATE, PREPARATION METHOD THEREFOR AND USES THEREOF PASTEUR SANOFI DIAGNOSTICS (FR) 2000-11-15 — — EP claimed