Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 2/20 | 0.38 |
| ▸ | IL1B | P01584 | 1/20 | 0.38 |
| ▸ | KIF11 | P52732 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 5/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.36 |
| ▸ | PIK3R2 | O00459 | 1/20 | 0.36 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11755492 | 0.88 | TSHR (0.40) | MAP2K4MAPTTP53RORCSCN9A | |
| SCHEMBL11752156 | 0.80 | F2 (0.40) | P2RX7IL1BMAPTTP53KDM4E | |
| SCHEMBL186237 | 0.70 | MAP2K4 (0.41) | MAP2K4MAPTKDM4EALDH1A1GAA | |
| SCHEMBL11751236 | 0.69 | KDM4E (0.40) | MAPTTP53KDM4EALDH1A1GLA | |
| SCHEMBL11752453 | 0.68 | ALDH1A1 (0.46) | CYP2C9MAPTKDM4EALDH1A1HPGD | |
| SCHEMBL17322885 | 0.66 | KMT2A (0.63) | MAPTRORCKDM4EALDH1A1GAA | |
| SCHEMBL24244952 | 0.66 | MAP2K4 (0.42) | KIF11CYP2C9MAP2K4TP53AURKA | |
| SCHEMBL185524 | 0.66 | MAP2K4 (0.39) | MAP2K4KDM4EALDH1A1 | |
| SCHEMBL421224 | 0.65 | KDR (0.41) | MAP2K4ALDH1A1HPGD | |
| SCHEMBL11748834 | 0.65 | KDM4E (0.46) | MAPTTP53KDM4EALDH1A1ELANE |
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 |
|---|---|---|---|---|---|---|---|
| US-4051252-A | ANALGESIC, ANTIINFLAMMATORY, ANTIPYRETIC | BAYER AKTIENGESELLSCHAFT (DT) | 1977-09-27 | — | — | US | disclosed |