Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | PDE1A | P54750 | 3/20 | 0.38 |
| ▸ | PDE1B | Q01064 | 3/20 | 0.38 |
| ▸ | PDE1C | Q14123 | 3/20 | 0.38 |
| ▸ | PDE2A | O00408 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | PDE5A | O76074 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8937183 | 0.84 | KDM4E (0.43) | KDM4ENPSR1ALDH1A1MEN1KMT2A | |
| SCHEMBL1804901 | 0.81 | KDM4E (0.41) | KDM4ENPSR1ALDH1A1MEN1KMT2A | |
| SCHEMBL2476718 | 0.80 | MEN1 (0.45) | KDM4ENPSR1ALDH1A1MEN1KMT2A | |
| SCHEMBL19013418 | 0.78 | KDM4E (0.40) | KDM4EALDH1A1MEN1KMT2AGAA | |
| SCHEMBL4623478 | 0.74 | KDM4E (0.38) | KDM4ENPSR1ALDH1A1MEN1KMT2A | |
| SCHEMBL5647 | 0.72 | ADORA2A (0.43) | KDM4ENPSR1ALDH1A1MEN1KMT2A | |
| SCHEMBL9765951 | 0.69 | ADORA2A (0.49) | KDM4EALDH1A1MEN1KMT2AHPGD | |
| SCHEMBL4796600 | 0.69 | PDE4A (0.47) | KDM4EALDH1A1MEN1KMT2AGAA | |
| SCHEMBL23797830 | 0.69 | HTT (0.42) | KDM4EALDH1A1MEN1KMT2AGAA | |
| SCHEMBL4623658 | 0.68 | PDE4A (0.39) | KDM4ENPSR1ALDH1A1MEN1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1208100-A1 | SELECTIVE ANTAGONISTS OF A2B ADENOSINE RECEPTORS | VANDERBILT UNIVERSITY (US) | 2002-05-29 | — | — | EP | disclosed |
| WO-2001016134-A1 | SELECTIVE ANTAGONISTS OF A2B ADENOSINE RECEPTORS | VANDERBILT UNIVERSITY (US) | 2001-03-08 | — | — | WO | disclosed |