Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.49 |
| ▸ | NPC1 | O15118 | 4/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | AKR1C3 | P42330 | 4/20 | 0.47 |
| ▸ | AKR1C2 | P52895 | 4/20 | 0.47 |
| ▸ | MMP2 | P08253 | 1/20 | 0.46 |
| ▸ | MMP9 | P14780 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.44 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.44 |
| ▸ | AKR1C4 | P17516 | 2/20 | 0.44 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28641030 | 1.00 | RAB9A (0.49) | RAB9ANPC1SMN1; SMN2MAPTMAPK1 | |
| SCHEMBL28760471 | 0.89 | AKR1C3 (0.47) | RAB9ANPC1SMN1; SMN2MAPTMAPK1 | |
| SCHEMBL28484882 | 0.82 | SMN1; SMN2 (0.54) | RAB9ANPC1SMN1; SMN2MAPTMAPK1 | |
| SCHEMBL13931954 | 0.82 | MAPK1 (0.46) | RAB9ANPC1SMN1; SMN2MAPTMAPK1 | |
| SCHEMBL19063495 | 0.81 | TSHR (0.51) | RAB9ANPC1ALDH1A1CA12CA2 | |
| SCHEMBL29643377 | 0.81 | TSHR (0.51) | RAB9ANPC1ALDH1A1CA12CA2 | |
| SCHEMBL14387571 | 0.79 | ALDH1A1 (0.42) | RAB9ANPC1SMN1; SMN2MAPTMAPK1 | |
| SCHEMBL19622953 | 0.79 | CASP3 (0.53) | SMN1; SMN2MAPTMAPK1ALDH1A1KMT2A | |
| SCHEMBL28041879 | 0.79 | VCAM1 (0.52) | SMN1; SMN2MAPTAKR1C3AKR1C2ALDH1A1 | |
| SCHEMBL4883148 | 0.78 | ALDH1A1 (0.47) | RAB9ANPC1SMN1; SMN2MAPTMAPK1 |
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-113429424-B | Preparation method of [1,2,4] oxadiazino indoline-3-ketone derivative | 华侨大学 | 2022-06-07 | — | — | CN | claimed |
| CN-113429424-B | Preparation method of [1,2,4] oxadiazino indoline-3-ketone derivative | 华侨大学 | 2022-06-07 | — | — | CN | disclosed |