Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 5/20 | 0.46 |
| ▸ | GRM5 | P41594 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | F11 | P03951 | 1/20 | 0.44 |
| ▸ | CTSA | P10619 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.42 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.41 |
| ▸ | PRKDC | P78527 | 1/20 | 0.41 |
| ▸ | ATR | Q13535 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9779218 | 0.92 | ADORA2A (0.44) | ADORA2AGRM5MAPTF11CTSA | |
| SCHEMBL9779661 | 0.82 | ALDH1A1 (0.51) | MAPTALDH1A1LMNASMN1; SMN2USP2 | |
| SCHEMBL9779414 | 0.81 | F11 (0.43) | ADORA2AGRM5MAPTF11CTSA | |
| SCHEMBL9779395 | 0.80 | TSHR (0.47) | MAPTALDH1A1LMNASMN1; SMN2USP2 | |
| Morpholine SCHEMBL9779664 | 0.78 | ADORA2A (0.44) | ADORA2AF11CTSAADORA1ADORA2B | |
| SCHEMBL9779442 | 0.77 | F11 (0.54) | ADORA2AF11ADORA1PIN1ALDH1A1 | |
| SCHEMBL9779192 | 0.73 | ADORA2A (0.53) | ADORA2AF11ADORA1ADORA2BATR | |
| SCHEMBL10430923 | 0.72 | GABRA1 (0.50) | ADORA2AMAPTF11ADORA1ADORA2B | |
| SCHEMBL9779393 | 0.72 | ADORA3 (0.51) | MAPTF11ADORA3PIN1ALDH1A1 | |
| SCHEMBL9779299 | 0.69 | F11 (0.55) | GRM5F11PIN1ALDH1A1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5037824-A | Cardiotonic, antiischemic agents | FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) | 1991-08-06 | — | — | US | disclosed |
| EP-0387070-A2 | N-Containing heterocyclic compounds, processes for the preparation thereof and composition comprising the same | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1990-09-12 | — | — | EP | disclosed |