Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.62 |
| ▸ | RAB9A | P51151 | 8/20 | 0.62 |
| ▸ | NPC1 | O15118 | 7/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.62 |
| ▸ | MEN1 | O00255 | 3/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | GAA | P10253 | 2/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | RARA | P10276 | 2/20 | 0.51 |
| ▸ | RARB | P10826 | 2/20 | 0.51 |
| ▸ | RARG | P13631 | 2/20 | 0.51 |
| ▸ | CRHBP | P24387 | 1/20 | 0.51 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.51 |
| ▸ | PPARA | Q07869 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL13680487 | 0.86 | ALDH1A1 (0.49) | KDM4ERAB9ANPC1SMN1; SMN2MEN1 | |
| SCHEMBL7399253 | 0.85 | EIF4E (0.52) | KDM4ERAB9ANPC1SMN1; SMN2MEN1 | |
| SCHEMBL13680482 | 0.85 | TGFBR1 (0.51) | KDM4ERAB9ANPC1SMN1; SMN2MEN1 | |
| SCHEMBL8198560 | 0.83 | CYP3A4 (0.60) | KDM4ERAB9ANPC1SMN1; SMN2MEN1 | |
| SCHEMBL13680524 | 0.82 | MAPT (0.58) | KDM4ERAB9ANPC1SMN1; SMN2MEN1 | |
| SCHEMBL13680527 | 0.82 | RAB9A (0.66) | RAB9ANPC1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL13680528 | 0.82 | ALDH1A1 (0.45) | KDM4ERAB9ANPC1SMN1; SMN2MEN1 | |
| SCHEMBL7905176 | 0.81 | CYP3A4 (0.58) | KDM4ERAB9ANPC1SMN1; SMN2MEN1 | |
| SCHEMBL13681289 | 0.81 | PPARA (0.46) | KDM4ERAB9ANPC1SMN1; SMN2MEN1 | |
| SCHEMBL3741835 | 0.81 | KDM4E (0.49) | KDM4ERAB9ANPC1SMN1; SMN2MEN1 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115286592-A | GLUT1 inhibitor, virtual screening method and application | 武汉工程大学 | 2022-11-04 | — | — | CN | disclosed |
| US-7582658-B2 | Bicyclic compound | ASAHI KASEI PHARMA CORPORATION (JP) | 2009-09-01 | — | — | US | disclosed |
| US-7582658-B2 | Bicyclic compound | ASAHI KASEI PHARMA CORPORATION (JP) | 2009-09-01 | — | — | US | disclosed |