Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.57 |
| ▸ | LMNA | P02545 | 3/20 | 0.57 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | UBE2N | P61088 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3162785 | 0.88 | MEN1 (0.54) | SMN1; SMN2LMNAHTTALDH1A1KMT2A | |
| SCHEMBL3161698 | 0.86 | ALDH1A1 (0.54) | SMN1; SMN2LMNAHTTALDH1A1KMT2A | |
| SCHEMBL3161449 | 0.85 | DRD4 (0.49) | ALDH1A1KMT2AMEN1 | |
| SCHEMBL3172018 | 0.85 | MEN1 (0.42) | ALDH1A1KMT2AMEN1 | |
| SCHEMBL3171582 | 0.84 | MEN1 (0.47) | POLBALDH1A1KMT2AMEN1 | |
| SCHEMBL3169342 | 0.84 | CA1 (0.45) | SMN1; SMN2LMNAHTTPOLBALDH1A1 | |
| SCHEMBL3164709 | 0.83 | NPC1 (0.47) | POLBALDH1A1KMT2AMEN1 | |
| SCHEMBL3163125 | 0.83 | NPC1 (0.47) | POLBALDH1A1KMT2AMEN1 | |
| SCHEMBL3171949 | 0.83 | PARP1 (0.47) | ALDH1A1KMT2AMEN1 | |
| SCHEMBL3163330 | 0.83 | NPSR1 (0.48) | SMN1; SMN2LMNAHTTPOLBALDH1A1 |
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 |