Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 4/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.47 |
| ▸ | CFTR | P13569 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 5/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL3161933 | 0.90 | CYP1A2 (0.58) | KMT2AMEN1MAPTCYP1A2CYP3A4 | |
| SCHEMBL3163026 | 0.89 | MEN1 (0.50) | KMT2AMEN1MAPTCYP1A2CYP3A4 | |
| SCHEMBL3175921 | 0.88 | TRPV1 (0.51) | KMT2AMEN1MAPTCYP3A4ALDH1A1 | |
| SCHEMBL3156001 | 0.87 | ADORA2A (0.56) | KMT2AMEN1MAPTCYP1A2CYP3A4 | |
| SCHEMBL3171746 | 0.87 | TP53 (0.49) | KMT2AMEN1MAPTCYP1A2CYP3A4 | |
| SCHEMBL3167813 | 0.87 | ADORA2A (0.56) | KMT2AMEN1MAPTCYP1A2CYP3A4 | |
| SCHEMBL3156347 | 0.87 | TP53 (0.52) | KMT2AMEN1MAPTCYP1A2CYP3A4 | |
| SCHEMBL3170716 | 0.87 | MAPT (0.53) | KMT2AMEN1MAPTCLK4NPC1 | |
| SCHEMBL3170473 | 0.87 | NPC1 (0.54) | KMT2AMEN1MAPTCYP1A2CYP3A4 | |
| SCHEMBL3175707 | 0.86 | ALDH1A1 (0.53) | KMT2AMEN1MAPTCYP1A2CYP3A4 |
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-1465631-B1 | PYRIMIDINE A2B SELECTIVE ANTAGONIST COMPOUNDS, THEIR SYNTHESIS AND USE | OSI PHARM INC (US) | 2010-02-24 | — | — | EP | disclosed |