Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.58 |
| ▸ | MAOB | P27338 | 10/20 | 0.51 |
| ▸ | NPC1 | O15118 | 4/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | PPARD | Q03181 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | HMGCR | P04035 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | APP | P05067 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL27834118 | 0.88 | HMGCR (0.47) | HSP90AB1MAOBNPC1RAB9AKMT2A | |
| SCHEMBL7521761 | 0.86 | HSP90AB1 (0.60) | HSP90AB1MAOBNPC1RAB9AKMT2A | |
| SCHEMBL27979074 | 0.85 | HSP90AB1 (0.58) | HSP90AB1MAOBPPARDPOLB | |
| SCHEMBL3297118 | 0.84 | PPARD (0.54) | MAOBNPC1RAB9APPARDALDH1A1 | |
| SCHEMBL3210641 | 0.84 | MAOB (0.65) | MAOBPPARDALDH1A1CYP3A4HPGD | |
| SCHEMBL28060507 | 0.84 | HSP90AB1 (0.66) | HSP90AB1MAOBNPC1RAB9AKMT2A | |
| SCHEMBL5711690 | 0.84 | HSP90AB1 (0.57) | HSP90AB1MAOBTP53 | |
| SCHEMBL5711597 | 0.84 | HSP90AB1 (0.57) | HSP90AB1MAOBTP53 | |
| SCHEMBL27688365 | 0.84 | THRA (0.53) | HSP90AB1MAOBMAPTHMGCR | |
| SCHEMBL3900807 | 0.83 | CA12 (0.60) | MAOBNPC1RAB9APPARDMAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-103804390-A | Polysubstituted aromatic diketone compounds as well as preparation method and application thereof | UNIV BEIJING TECHNOLOGY | 2014-05-21 | — | — | CN | disclosed |
| CN-101282725-A | Therapeutic agent for diabetes | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2008-10-08 | — | — | CN | disclosed |