Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | PLAU | P00749 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16486471 | 0.88 | MAPT (0.34) | MAPTGAAPLAUKDM4EALDH1A1 | |
| SCHEMBL30030411 | 0.76 | IDO1 (0.32) | PLAU | |
| SCHEMBL27368384 | 0.76 | IDO1 (0.32) | PLAU | |
| SCHEMBL5417333 | 0.72 | NOS2 (0.44) | GAAPLAUKDM4EALDH1A1 | |
| SCHEMBL27459327 | 0.71 | — | — | |
| SCHEMBL28190715 | 0.71 | — | — | |
| SCHEMBL28190714 | 0.69 | CASP1 (0.32) | — | |
| SCHEMBL1096641 | 0.68 | MAOA (0.36) | MAPTPLAUKDM4EALDH1A1MAPK1 | |
| SCHEMBL7247395 | 0.65 | KDM4E (0.41) | MAPTKDM4EALDH1A1PKMMAPK1 | |
| SCHEMBL28072453 | 0.64 | ALDH1A1 (0.33) | ALDH1A1 |
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-105837522-A | Preparation method of 1,5-benzodiazepine-one derivative | 绍兴文理学院 | 2016-08-10 | — | — | CN | claimed |
| CN-105837522-A | Preparation method of 1,5-benzodiazepine-one derivative | 绍兴文理学院 | 2016-08-10 | — | — | CN | disclosed |
| CN-104797569-A | Substituted 1,5-benzodiazepinone compounds | BRISTOL MYERS SQUIBB CO | 2015-07-22 | — | — | CN | disclosed |