Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 4/20 | 0.54 |
| ▸ | MTOR | P42345 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | XDH | P47989 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | LGMN | Q99538 | 1/20 | 0.41 |
| ▸ | DHFR | P00374 | 1/20 | 0.41 |
| ▸ | TYMP | P19971 | 1/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.39 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 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 | |
|---|---|---|---|---|
| SCHEMBL7716610 | 0.81 | POLB (0.48) | KMT2APOLBMAPTLMNAGAA | |
| SCHEMBL10328001 | 0.72 | PIK3CA (0.70) | PIK3CAMTORKMT2AMEN1POLB | |
| SCHEMBL15014928 | 0.71 | PIK3CA (0.41) | PIK3CAMTORKMT2AMEN1POLB | |
| SCHEMBL10327727 | 0.71 | PIK3CA (1.00) | PIK3CAMTORKMT2AMEN1POLB | |
| SCHEMBL30450188 | 0.71 | MEN1 (0.42) | PIK3CAMTORKMT2AMEN1POLB | |
| SCHEMBL4102801 | 0.70 | PIK3CA (0.40) | PIK3CAMTORKMT2AMEN1POLB | |
| SCHEMBL11680654 | 0.69 | MEN1 (0.53) | PIK3CAMTORKMT2AMEN1POLB | |
| SCHEMBL3768169 | 0.68 | MAPT (0.69) | MTORKMT2AMEN1POLBMAPT | |
| SCHEMBL21358271 | 0.68 | DHFR (0.74) | PIK3CAMTORDHFRPIK3R1 | |
| SCHEMBL30766045 | 0.68 | KMT2A (0.51) | PIK3CAMTORKMT2AMEN1POLB |
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-6440965-B1 | Substituted pyrimidine derivatives, their preparation and their use in the treatment of neurodegenerative or neurological disorders of the central nervous system | KRENITSKY PHARMACEUTICALS, INC. | 2002-08-27 | — | — | US | disclosed |