Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 4/20 | 0.42 |
| ▸ | TLR9 | Q9NR96 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | MITF | O75030 | 1/20 | 0.42 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5413235 | 0.82 | BPTF (0.48) | L3MBTL1MAPK1HSD17B10CYP1A2CYP3A4 | |
| SCHEMBL15487561 | 0.80 | CYP3A4 (0.48) | MAPK1HSD17B10CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5416222 | 0.80 | LRRK2 (0.51) | MAPK1HSD17B10NPC1TLR9MAPT | |
| SCHEMBL6866618 | 0.76 | MAPT (0.49) | L3MBTL1MAPK1HSD17B10NPC1TLR9 | |
| SCHEMBL6884800 | 0.76 | L3MBTL1 (0.43) | L3MBTL1MAPK1HSD17B10NPC1TLR9 | |
| SCHEMBL6862075 | 0.75 | AURKA (0.45) | MAPK1HSD17B10CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL6216960 | 0.74 | MAPT (0.42) | L3MBTL1MAPK1HSD17B10NPC1TLR9 | |
| SCHEMBL4015259 | 0.72 | L3MBTL1 (0.45) | L3MBTL1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL4736374 | 0.72 | SIK2 (0.45) | L3MBTL1NPC1TLR9MAPTLMNA | |
| SCHEMBL6016411 | 0.71 | L3MBTL1 (0.50) | L3MBTL1MAPK1HSD17B10NPC1TLR9 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1187338-C | 5-phenyl-pyrimidine derivatives | HOFFMANN LA ROCHE (CH) | 2005-02-02 | — | — | CN | disclosed |
| US-6756380-B1 | NEUROKININ 1 RECEPTOR ANTAGONISTS | HOFFMANN-LA ROCHE INC. | 2004-06-29 | — | — | US | disclosed |
| CN-1353696-A | 5-phenyl-pyrimidine derivatives | HOFFMANN LA ROCHE (CH) | 2002-06-12 | — | — | CN | disclosed |
| EP-1187814-A2 | 5-PHENYL-PYRIMIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2002-03-20 | — | — | EP | disclosed |
| WO-2000073278-A2 | 5-PHENYL-PYRIMIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2000-12-07 | — | — | WO | disclosed |