Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.37 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.36 |
| ▸ | DHODH | Q02127 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.34 |
| ▸ | ACR | P10323 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28638963 | 0.81 | ALDH1A1 (0.40) | MAPTTDP1L3MBTL1NPSR1KDM4E | |
| SCHEMBL28647685 | 0.78 | DHODH (0.43) | MAPTTDP1L3MBTL1KDM4EAKR1C3 | |
| SCHEMBL1189043 | 0.76 | HSD17B10 (0.47) | MAPTTDP1KDM4EHSD17B10ALDH1A1 | |
| SCHEMBL27568692 | 0.75 | HSD17B10 (0.57) | KDM4EHSD17B10ALDH1A1THRBMEN1 | |
| SCHEMBL235518 | 0.75 | HSD17B10 (0.57) | KDM4EHSD17B10ALDH1A1THRBMEN1 | |
| SCHEMBL30423759 | 0.75 | HSD17B10 (0.57) | KDM4EHSD17B10ALDH1A1THRBMEN1 | |
| SCHEMBL28009711 | 0.73 | HSD17B10 (0.45) | MAPTTDP1KDM4EHSD17B10ALDH1A1 | |
| SCHEMBL28009713 | 0.73 | HSD17B10 (0.45) | MAPTTDP1KDM4EHSD17B10ALDH1A1 | |
| SCHEMBL28638961 | 0.72 | MAPT (0.43) | MAPTTDP1L3MBTL1NPSR1KDM4E | |
| SCHEMBL28641142 | 0.71 | TSHR (0.51) | TDP1L3MBTL1KDM4EDHODHHSD17B10 |
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-112778137-A | End-position nitrated 3, 4-perylene dicarboxylic ester compound and synthetic method and application thereof | 山东师范大学 | 2021-05-11 | — | — | CN | disclosed |