Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 1/20 | 0.33 |
| ▸ | DDO | Q99489 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 9/20 | 0.33 |
| ▸ | PRKCA | P17252 | 1/20 | 0.32 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | SYK | P43405 | 3/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | F2 | P00734 | 1/20 | 0.31 |
| ▸ | F12 | P00748 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9925250 | 0.88 | GOT1 (0.36) | HSP90AA1MAPTGAA | |
| SCHEMBL419803 | 0.81 | HSD11B1 (0.38) | HSP90AA1KDM4ELMNAMAPTGAA | |
| SCHEMBL12180120 | 0.77 | AOC3 (0.38) | KDM4EALDH1A1LMNAMAPTHPGD | |
| SCHEMBL3974853 | 0.77 | ALDH1A1 (0.35) | DAODDOHSP90AA1PRKCAPRKCQ | |
| SCHEMBL806552 | 0.76 | GAA (0.34) | SYKGAA | |
| SCHEMBL2596689 | 0.76 | DAO (0.34) | DAODDOHSP90AA1KDM4EALDH1A1 | |
| SCHEMBL12908734 | 0.75 | PDE4D (0.37) | HSP90AA1KDM4EALDH1A1LMNAMAPT | |
| SCHEMBL931405 | 0.74 | KMT2A (0.48) | KDM4EALDH1A1LMNAMAPTHPGD | |
| SCHEMBL1539292 | 0.73 | HSP90AA1 (0.36) | DAODDOHSP90AA1KDM4EALDH1A1 | |
| SCHEMBL12180125 | 0.72 | GOT1 (0.39) | ALDH1A1MAPTGAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011146801-A1 | FORMULATION AND DOSING OF HSP90 INHIBITORY COMPOUNDS | SYNTA PHARMACEUTICALS CORP. (US) | 2011-11-24 | — | — | WO | claimed |
| WO-2011146801-A1 | FORMULATION AND DOSING OF HSP90 INHIBITORY COMPOUNDS | SYNTA PHARMACEUTICALS CORP. (US) | 2011-11-24 | — | — | WO | disclosed |