Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 1/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.47 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.47 |
| ▸ | BRD4 | O60885 | 1/20 | 0.45 |
| ▸ | PARG | Q86W56 | 1/20 | 0.44 |
| ▸ | FEN1 | P39748 | 2/20 | 0.40 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.40 |
| ▸ | DNASE1 | P24855 | 1/20 | 0.40 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | GLA | P06280 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL2116094 | 0.85 | HTR3A (0.50) | HTR3AADORA3ADORA2AADORA2BADORA1 | |
| SCHEMBL2115896 | 0.80 | KDM4E (0.58) | ADORA3ADORA2AADORA2BADORA1BRD4 | |
| SCHEMBL9760930 | 0.76 | ADORA3 (0.56) | HTR3AADORA3ADORA2AADORA2BADORA1 | |
| SCHEMBL2116506 | 0.74 | HTR3A (0.62) | HTR3AADORA3ADORA2AADORA2BADORA1 | |
| SCHEMBL9919006 | 0.72 | FEN1 (0.66) | ADORA3ADORA2AADORA2BADORA1BRD4 | |
| SCHEMBL8215674 | 0.70 | ADORA3 (0.61) | ADORA3ADORA2AADORA2BADORA1BRD4 | |
| SCHEMBL9919007 | 0.69 | CA9 (0.66) | ADORA3ADORA2AADORA2BADORA1PARG | |
| SCHEMBL9923029 | 0.69 | ADORA3 (0.59) | HTR3AADORA3ADORA2AADORA2BADORA1 | |
| SCHEMBL5712368 | 0.69 | ADORA3 (0.59) | ADORA3ADORA2AADORA2BADORA1BRD4 | |
| SCHEMBL5355203 | 0.69 | CA12 (0.66) | ADORA3ADORA2AADORA2BADORA1BRD4 |
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-2012054332-A1 | SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2012-04-26 | — | — | WO | disclosed |