SCHEMBL28977981

SCHEMBL28977981

N[C@@H](Cc1cn([Cd])cn1)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SLC7A5 Q01650 3/20 0.44
▸ ALPI P09923 1/20 0.44
▸ PKM P14618 1/20 0.44
▸ PTGS1 P23219 1/20 0.44
▸ XIAP P98170 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ SLC1A3 P43003 1/20 0.41
▸ CPB2 Q96IY4 6/20 0.40
▸ CPB1 P15086 1/20 0.40
▸ TYR P14679 5/20 0.40
▸ GRIA1 P42261 1/20 0.39
▸ GRIA2 P42262 1/20 0.39
▸ GRIA3 P42263 1/20 0.39
▸ GRIA4 P48058 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38

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
SCHEMBL28977985 1.00 SLC7A5 (0.44) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL27974517 0.83 CYP1A2 (0.46) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL14798187 0.81 CYP1A2 (0.45) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL60911 0.81 CYP1A2 (0.45) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL44187 0.81 CYP1A2 (0.45) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL4726518 0.81 CYP1A2 (0.45) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL4727798 0.81 CYP1A2 (0.45) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL358922 0.80 CYP1A2 (0.44) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL2303962 0.80 CYP1A2 (0.44) SLC7A5ALPIPKMPTGS1XIAP
Hydrochloric Acid SCHEMBL6697015 0.80 TYR (0.45) SLC7A5ALPIPKMPTGS1XIAP

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
CN-115724801-A Metal complex glass material with circular polarization luminescence characteristic and preparation method thereof 北京师范大学 2023-03-03 — — CN disclosed
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