Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.41 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3156119 | 0.93 | PHGDH (0.42) | KMT2ASMN1; SMN2ALDH1A1LMNANPC1 | |
| SCHEMBL3156223 | 0.90 | KMT2A (0.42) | KMT2ASMN1; SMN2ALDH1A1LMNANPC1 | |
| SCHEMBL3164424 | 0.90 | ADORA2A (0.41) | KMT2AALDH1A1ALOX15ADORA2AADORA1 | |
| SCHEMBL3166495 | 0.88 | SLC1A2 (0.44) | KMT2AALDH1A1LMNAKDM4EALOX15 | |
| SCHEMBL3175820 | 0.88 | MEN1 (0.46) | KMT2AALDH1A1KDM4EADRA1AMEN1 | |
| SCHEMBL3165360 | 0.88 | PHGDH (0.43) | ALDH1A1LMNAKDM4EALOX15ADORA2A | |
| SCHEMBL3163864 | 0.88 | LMNA (0.43) | KMT2AALDH1A1LMNAKDM4EADORA2A | |
| SCHEMBL3175769 | 0.87 | ADORA2A (0.45) | ALDH1A1LMNAKDM4EALOX15ADORA2A | |
| SCHEMBL3170498 | 0.86 | TSHR (0.41) | KMT2AALDH1A1LMNAKDM4EALOX15 | |
| SCHEMBL3155892 | 0.86 | ADORA2A (0.46) | ALDH1A1LMNAKDM4EALOX15ADORA2A |
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 |