Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PBRM1 | Q86U86 | 3/20 | 0.45 |
| ▸ | BRAF | P15056 | 1/20 | 0.41 |
| ▸ | EIF2AK3 | Q9NZJ5 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | HTR6 | P50406 | 2/20 | 0.36 |
| ▸ | TOP2A | P11388 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | GMNN | O75496 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5698452 | 0.75 | KDM4E (0.44) | KDM4EALDH1A1HPGDSMN1; SMN2HTR6 | |
| Hydrochloric Acid SCHEMBL5698504 | 0.73 | PARP1 (0.36) | PARP1KDM4EALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL5698624 | 0.72 | KDM4E (0.45) | PARP1KDM4EALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL22048844 | 0.70 | PARP1 (0.52) | PARP1KDM4EALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL15374747 | 0.70 | PARP1 (0.55) | PARP1KDM4EALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL15374721 | 0.70 | PARP1 (0.55) | PARP1KDM4EALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL17298998 | 0.70 | PARP1 (0.55) | PARP1KDM4EALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL743939 | 0.70 | PARP1 (0.55) | PARP1KDM4EALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL5698501 | 0.69 | MKNK1 (0.39) | PARP1PIM1PIM2 | |
| Hydrochloric Acid SCHEMBL5698636 | 0.68 | KDM4E (0.43) | PARP1KDM4EALDH1A1HPGDSMN1; SMN2 |
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 |