Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNMA1 | Q12791 | 8/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 3/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.37 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.37 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.37 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.35 |
| ▸ | METAP2 | P50579 | 1/20 | 0.35 |
| ▸ | METAP1 | P53582 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL16751762 | 0.85 | PARP1 (0.45) | KCNMA1ADORA3ADORA2APARP1GABRA1 | |
| SCHEMBL16751748 | 0.82 | GABRA1 (0.42) | PARP1GABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL16751645 | 0.77 | KCNMA1 (0.36) | KCNMA1ADORA3ADORA2APARP1GABRA1 | |
| SCHEMBL16751608 | 0.74 | PARP1 (0.47) | KCNMA1ADORA3ADORA2APARP1GABRA1 | |
| SCHEMBL16751750 | 0.73 | GABRA1 (0.43) | PARP1GABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL16751702 | 0.73 | GABRA1 (0.42) | ADORA3ADORA2APARP1GABRA1GABRG2 | |
| SCHEMBL16751652 | 0.71 | GABRA1 (0.39) | KCNMA1ADORA3ADORA2APARP1GABRA1 | |
| SCHEMBL16751618 | 0.70 | MAPK14 (0.36) | PARP1GABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL12396542 | 0.69 | PARP1 (0.55) | KCNMA1ADORA3ADORA2APARP1GABRA1 | |
| SCHEMBL30322789 | 0.69 | PARP1 (0.55) | KCNMA1ADORA3ADORA2APARP1GABRA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015076600-A1 | NOVEL LIGHT EMISSION COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME | 주식회사 동진쎄미켐 | 2015-05-28 | — | — | WO | disclosed |