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Sugi Predict / Compounds / Isoleucine

Isoleucine

Isoleucine

SCHEMBL7722173

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nearest known ligand 0.42

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Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SLC7A5 Q01650 2/20 0.42
▸ SLC1A1 P43005 3/20 0.33
▸ SLC1A3 P43003 2/20 0.33
▸ SLC1A2 P43004 2/20 0.33
▸ DPP4 P27487 1/20 0.31
▸ DPP8 Q6V1X1 1/20 0.31
▸ DPP9 Q86TI2 1/20 0.31
▸ GRIK1 P39086 1/20 0.30
▸ GRIA4 P48058 1/20 0.30
▸ GRIK3 Q13003 1/20 0.30
▸ GRIK5 Q16478 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
Isoleucine SCHEMBL7722171 0.88 SLC7A5 (0.54) SLC7A5SLC1A1SLC1A3SLC1A2DPP4
Serine SCHEMBL18694955 0.87 SLC1A1 (0.39) SLC7A5SLC1A1SLC1A3SLC1A2DPP4
SCHEMBL3653479 0.83 DPP4 (0.39) DPP4DPP8DPP9
Isoleucine SCHEMBL1537443 0.83 SLC1A1 (0.44) SLC7A5SLC1A1SLC1A3SLC1A2DPP4
Isoleucine SCHEMBL18694957 0.83 SLC1A1 (0.44) SLC7A5SLC1A1SLC1A3SLC1A2DPP4
Isoleucine SCHEMBL3653477 0.83 SLC1A1 (0.44) SLC7A5SLC1A1SLC1A3SLC1A2DPP4
Isoleucine SCHEMBL16401005 0.83 SLC1A1 (0.44) SLC7A5SLC1A1SLC1A3SLC1A2DPP4
Isoleucine SCHEMBL1537449 0.83 SLC1A1 (0.44) SLC7A5SLC1A1SLC1A3SLC1A2DPP4
SCHEMBL723257 0.82 SLC7A5 (0.39) SLC7A5SLC1A1SLC1A3SLC1A2DPP4
SCHEMBL1446935 0.78 DPP4 (0.42) SLC7A5DPP4DPP8DPP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1015479-A4 COMBINATORIAL LIBRARIES OF PEPTIDOMIMETIC MACROCYCLES AND PROCESSES THEREFOR LILLY CO ELI (US) 2002-07-24 — — EP disclosed
EP-1015479-A1 COMBINATORIAL LIBRARIES OF PEPTIDOMIMETIC MACROCYCLES AND PROCESSES THEREFOR ELI LILLY AND COMPANY (US) 2000-07-05 — — EP disclosed
WO-1998046631-A1 COMBINATORIAL LIBRARIES OF PEPTIDOMIMETIC MACROCYCLES AND PROCESSES THEREFOR ELI LILLY AND COMPANY (US) 1998-10-22 — — WO disclosed
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