Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 1/20 | 0.34 |
| ▸ | DDO | Q99489 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 7/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | GAA | P10253 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.32 |
| ▸ | DHFR | P00374 | 1/20 | 0.32 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | NPEPPS | P55786 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13280018 | 0.89 | DAO (0.34) | DAODDOHSP90AA1MAPTGAA | |
| SCHEMBL1539292 | 0.87 | HSP90AA1 (0.36) | DAODDOHSP90AA1MAPTGAA | |
| SCHEMBL930712 | 0.79 | HCAR1 (0.37) | HSP90AA1MAPTGAAALDH1A1HPGD | |
| SCHEMBL421350 | 0.78 | KDM4E (0.35) | HSP90AA1MAPTGAAHPGDMEN1 | |
| SCHEMBL2596698 | 0.77 | HSP90AA1 (0.41) | HSP90AA1HSP90AB1 | |
| SCHEMBL2596691 | 0.76 | DAO (0.33) | DAODDOHSP90AA1MAPTGAA | |
| SCHEMBL3974314 | 0.75 | DAO (0.34) | DAODDOHSP90AA1MAPTGAA | |
| SCHEMBL1586624 | 0.74 | GAA (0.33) | HSP90AA1MAPTGAAALDH1A1HPGD | |
| SCHEMBL2596685 | 0.73 | HSP90AA1 (0.35) | DAODDOHSP90AA1MAPTGAA | |
| SCHEMBL1881956 | 0.71 | NPEPPS (0.37) | DAODDOHSP90AA1MAPTGAA |
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-2011146801-A1 | FORMULATION AND DOSING OF HSP90 INHIBITORY COMPOUNDS | SYNTA PHARMACEUTICALS CORP. (US) | 2011-11-24 | — | — | WO | disclosed |