Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 2/20 | 0.38 |
| ▸ | CASR | P41180 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
| ▸ | CDC7 | O00311 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 3/20 | 0.34 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | XDH | P47989 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21751454 | 1.00 | ADORA3 (0.39) | ADORA3ADORA2AADORA1PARP1CASR | |
| SCHEMBL21751336 | 0.97 | ADORA3 (0.41) | ADORA3ADORA2AADORA1PARP1CASR | |
| SCHEMBL21751359 | 0.93 | ADORA3 (0.37) | ADORA3ADORA2AADORA1PARP1CASR | |
| SCHEMBL25760174 | 0.93 | CASR (0.38) | ADORA3ADORA2AADORA1PARP1CASR | |
| SCHEMBL2680751 | 0.93 | ABCB1 (0.40) | ADORA3ADORA2AADORA1PARP1ALDH1A1 | |
| SCHEMBL10196910 | 0.92 | PARP1 (0.38) | ADORA3ADORA2AADORA1PARP1CASR | |
| SCHEMBL19206714 | 0.92 | ALDH1A1 (0.38) | ADORA3ADORA2AADORA1PARP1CASR | |
| SCHEMBL25760164 | 0.91 | ADORA3 (0.37) | ADORA3ADORA2AADORA1PARP1CASR | |
| SCHEMBL25761034 | 0.91 | ADORA3 (0.39) | ADORA3ADORA2AADORA1PARP1CASR | |
| SCHEMBL21751461 | 0.91 | KDM4E (0.41) | ADORA3ALDH1A1GAACYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112513188-B | Coelenterazine analogs | 普洛麦格公司 | 2024-01-26 | — | — | CN | disclosed |