Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 4/20 | 0.57 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.57 |
| ▸ | AKR1C1 | Q04828 | 3/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.39 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5698436 | 1.00 | AKR1C3 (0.57) | AKR1C3AKR1C2AKR1C1SMN1; SMN2MAPT | |
| SCHEMBL6169890 | 0.84 | AKR1C1 (0.79) | AKR1C3AKR1C2AKR1C1SMN1; SMN2MAPT | |
| SCHEMBL6169895 | 0.84 | AKR1C1 (0.79) | AKR1C3AKR1C2AKR1C1SMN1; SMN2MAPT | |
| SCHEMBL6514404 | 0.82 | AKR1C3 (0.57) | AKR1C3AKR1C2AKR1C1SMN1; SMN2MAPT | |
| SCHEMBL6514407 | 0.82 | AKR1C3 (0.57) | AKR1C3AKR1C2AKR1C1SMN1; SMN2MAPT | |
| SCHEMBL5698531 | 0.81 | AKR1C3 (0.49) | AKR1C3AKR1C2AKR1C1SMN1; SMN2MAPT | |
| SCHEMBL5698524 | 0.81 | AKR1C3 (0.49) | AKR1C3AKR1C2AKR1C1SMN1; SMN2MAPT | |
| SCHEMBL6168027 | 0.81 | AKR1C3 (0.69) | AKR1C3AKR1C2AKR1C1SMN1; SMN2MAPT | |
| SCHEMBL6168025 | 0.81 | AKR1C3 (0.69) | AKR1C3AKR1C2AKR1C1SMN1; SMN2MAPT | |
| SCHEMBL5253681 | 0.81 | AKR1C1 (0.55) | AKR1C3AKR1C2AKR1C1MAPTALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1682143-A2 | COMBINATIONS COMPRISING AN HSP90 INHIBITOR AND A PHOPHODIESTERASE INHIBITOR FOR TREATING OR PREVENTING NEOPLASIA | Pharmacia Corporation (US) | 2006-07-26 | — | — | EP | disclosed |
| WO-2005044194-A2 | TREATMENT OR PREVENTION OF NEOPLASIA BY USE OF AN Hsp90 INHIBITOR | PHARMACIA CORPORATION (US) | 2005-05-19 | — | — | WO | disclosed |
| WO-2005041879-A2 | COMBINATIONS COMPRISING AN Hsp90 INHIBITOR AND A PHOPHODIESTERASE INHIBITOR FOR TREATING OR PREVENTING NEOPLASIA | PHARMACIA CORPORATION (US) | 2005-05-12 | — | — | WO | disclosed |