Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | FABP4 | P15090 | 3/20 | 0.44 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.41 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.41 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.41 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.41 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | GUCY1A1 | Q02108 | 1/20 | 0.40 |
| ▸ | GUCY1B1 | Q02153 | 1/20 | 0.40 |
| ▸ | NQO2 | P16083 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL864351 | 0.98 | KDM4E (0.47) | KDM4EALDH1A1GAAMAPTHSD17B10 | |
| SCHEMBL865777 | 0.87 | KDM4E (0.43) | KDM4EALDH1A1GAAMAPTHSD17B10 | |
| SCHEMBL3379700 | 0.84 | KDM4E (0.41) | KDM4EALDH1A1GAAMAPTHSD17B10 | |
| SCHEMBL864917 | 0.83 | KDM4E (0.40) | KDM4EALDH1A1GAAMAPTHSD17B10 | |
| SCHEMBL13496382 | 0.80 | GUCY1A1 (0.58) | KDM4EALDH1A1GAAMAPTHSD17B10 | |
| SCHEMBL864908 | 0.79 | KDM4E (0.50) | KDM4EALDH1A1GAAMAPTHSD17B10 | |
| SCHEMBL864262 | 0.79 | ALDH1A1 (0.51) | KDM4EALDH1A1GAAMAPTHSD17B10 | |
| SCHEMBL4825292 | 0.78 | NQO2 (0.51) | KDM4EALDH1A1GAAMAPTHSD17B10 | |
| SCHEMBL12959658 | 0.77 | PRSS1 (0.41) | PRSS1HDAC6 | |
| SCHEMBL864589 | 0.76 | MAPT (0.54) | KDM4EMAPTLMNAPRSS1TDP1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108676007-B | Radionuclide-labeled benzopteridine derivative and preparation method and application thereof | 厦门大学 | 2020-06-26 | — | — | CN | disclosed |