Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | GLA | P06280 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | AKT1 | P31749 | 3/20 | 0.32 |
| ▸ | AKT2 | P31751 | 3/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | CCR5 | P51681 | 1/20 | 0.31 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 4/20 | 0.30 |
| ▸ | GAA | P10253 | 3/20 | 0.30 |
| ▸ | NPC1 | O15118 | 2/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL31579337 | 0.95 | CNR2 (0.34) | KDM4EALDH1A1HPGDGLAHSD17B10 | |
| SCHEMBL7233276 | 0.93 | ALDH1A1 (0.34) | KDM4EALDH1A1HPGDGLAHSD17B10 | |
| SCHEMBL3952103 | 0.69 | PDE10A (0.31) | ALDH1A1 | |
| SCHEMBL7226773 | 0.69 | AKT1 (0.34) | AKT1AKT2 | |
| SCHEMBL15767503 | 0.67 | ALDH1A1 (0.51) | KDM4EALDH1A1HPGDGLAHSD17B10 | |
| SCHEMBL5808966 | 0.66 | RAB9A (0.39) | KDM4EALDH1A1HPGDGLAHSD17B10 | |
| SCHEMBL29334095 | 0.66 | KDM4E (0.39) | KDM4EALDH1A1HPGDGLAHSD17B10 | |
| SCHEMBL6102107 | 0.66 | ALDH1A1 (0.39) | KDM4EALDH1A1HPGDGLAHSD17B10 | |
| SCHEMBL2398490 | 0.66 | NUDT1 (0.40) | KDM4EALDH1A1HPGDGLAHSD17B10 | |
| SCHEMBL5769043 | 0.66 | ALDH1A1 (0.38) | KDM4EALDH1A1HPGDGLAHSD17B10 |
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-6642229-B2 | Treatment of adverse neurological conditions | MERCK SHARP & DOHME LTD. | 2003-11-04 | — | — | US | disclosed |