Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | CDC25B | P30305 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.49 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.49 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.49 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL29843143 | 1.00 | AKR1C3 (0.62) | AKR1C3ALDH1A1LMNATDP1MAPT | |
| SCHEMBL28116437 | 0.95 | AKR1C3 (0.66) | AKR1C3ALDH1A1LMNATDP1MAPT | |
| SCHEMBL5693606 | 0.95 | AKR1C3 (0.61) | AKR1C3ALDH1A1LMNATDP1MAPT | |
| SCHEMBL23758169 | 0.92 | SLC6A4 (0.56) | AKR1C3ALDH1A1LMNATDP1MAPT | |
| SCHEMBL15660913 | 0.92 | SLC6A4 (0.56) | AKR1C3ALDH1A1LMNATDP1MAPT | |
| SCHEMBL30448294 | 0.91 | AKR1C3 (0.67) | AKR1C3ALDH1A1LMNATDP1MAPT | |
| SCHEMBL16882044 | 0.90 | KMT2A (0.48) | AKR1C3ALDH1A1LMNATDP1MAPT | |
| SCHEMBL29066920 | 0.86 | ALDH1A1 (0.67) | AKR1C3ALDH1A1LMNATDP1MAPT | |
| SCHEMBL29367957 | 0.86 | AKR1C3 (0.51) | AKR1C3ALDH1A1LMNATDP1MAPT | |
| SCHEMBL27415726 | 0.86 | AKR1C3 (0.51) | AKR1C3ALDH1A1LMNATDP1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-3514139-A1 | FLUORINE-BASED COMPOUND, ORGANIC LIGHT-EMITTING DEVICE USING SAME AND METHOD FOR PREPARING SAME | LG Chem, Ltd. (KR) | 2019-07-24 | — | — | EP | disclosed |