Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.59 |
| ▸ | AGXT | P21549 | 2/20 | 0.59 |
| ▸ | MMP1 | P03956 | 2/20 | 0.52 |
| ▸ | MMP2 | P08253 | 2/20 | 0.52 |
| ▸ | MMP9 | P14780 | 2/20 | 0.52 |
| ▸ | MMP12 | P39900 | 2/20 | 0.52 |
| ▸ | MAOB | P27338 | 6/20 | 0.51 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL30486011 | 0.84 | MMP1 (0.54) | IDO1AGXTMMP1MMP2MMP9 | |
| SCHEMBL5072089 | 0.84 | MMP1 (0.54) | IDO1AGXTMMP1MMP2MMP9 | |
| SCHEMBL3147684 | 0.83 | MMP1 (0.59) | IDO1AGXTMMP1MMP2MMP9 | |
| SCHEMBL27699824 | 0.81 | MMP1 (0.54) | IDO1AGXTMMP1MMP2MMP9 | |
| SCHEMBL28556983 | 0.81 | MMP1 (0.61) | IDO1AGXTMMP1MMP2MMP9 | |
| SCHEMBL31326237 | 0.81 | MMP1 (0.61) | IDO1AGXTMMP1MMP2MMP9 | |
| SCHEMBL31083932 | 0.79 | MMP1 (0.59) | IDO1AGXTMMP1MMP2MMP9 | |
| SCHEMBL11559086 | 0.79 | CTBP2 (0.54) | IDO1AGXTTAAR1 | |
| SCHEMBL27281567 | 0.79 | NPC1 (0.53) | IDO1AGXTMMP1MMP2MMP9 | |
| SCHEMBL1144902 | 0.78 | IDO1 (0.67) | IDO1AGXTMAOBTAAR1 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1867650-B1 | HYDROXYMETHYLBORON COMPOUNDS | EISAI R&D MAN CO LTD (JP) | 2012-06-27 | — | — | EP | disclosed |
| EP-1867650-A1 | HYDROXYMETHYLBORON COMPOUNDS | Eisai R&D Management Co., Ltd. (JP) | 2007-12-19 | — | — | EP | disclosed |