Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3155601 | 0.89 | ADORA2A (0.42) | TSHRADORA2AADORA1MAPTALDH1A1 | |
| SCHEMBL3165279 | 0.88 | CYP1A2 (0.43) | TSHRADORA2AADORA1ALDH1A1ADORA3 | |
| SCHEMBL3174104 | 0.87 | ADORA2A (0.41) | TSHRADORA2AADORA1MAPTALDH1A1 | |
| SCHEMBL3156223 | 0.87 | KMT2A (0.42) | MEN1KMT2AADORA2AADORA1MAPT | |
| SCHEMBL3164424 | 0.87 | ADORA2A (0.41) | TSHRKMT2AADORA2AADORA1ALDH1A1 | |
| SCHEMBL3166495 | 0.87 | SLC1A2 (0.44) | TSHRMEN1KMT2AADORA2AADORA1 | |
| SCHEMBL3260259 | 0.87 | ALDH1A1 (0.45) | TSHRMEN1KMT2AADORA2AADORA1 | |
| SCHEMBL3170204 | 0.86 | KMT2A (0.43) | TSHRMEN1KMT2AADORA2AADORA1 | |
| SCHEMBL3175769 | 0.86 | ADORA2A (0.45) | TSHRADORA2AADORA1MAPTALDH1A1 | |
| SCHEMBL3165360 | 0.85 | PHGDH (0.43) | ADORA2AADORA1ALDH1A1ADORA3LMNA |
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 |