Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 6/20 | 0.48 |
| ▸ | HSP90AB1 | P08238 | 6/20 | 0.48 |
| ▸ | FLT4 | P35916 | 1/20 | 0.47 |
| ▸ | KDR | P35968 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | DAPK1 | P53355 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NSD3 | Q9BZ95 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3396083 | 0.83 | HSP90AA1 (0.71) | HSP90AA1HSP90AB1FLT4KDRHPGD | |
| SCHEMBL3395811 | 0.76 | HSP90AA1 (0.57) | HSP90AA1HSP90AB1FLT4KDRHPGD | |
| SCHEMBL17364335 | 0.75 | ADORA2A (0.60) | FLT4KDRHPGDNPSR1DAPK1 | |
| SCHEMBL22326733 | 0.73 | ADORA2A (0.62) | FLT4KDRHPGDDAPK1TAAR1 | |
| SCHEMBL24021954 | 0.72 | FLT4 (0.53) | FLT4KDRHPGDDAPK1TAAR1 | |
| SCHEMBL8769186 | 0.70 | FLT4 (0.72) | FLT4KDRHPGDDAPK1TAAR1 | |
| SCHEMBL22533420 | 0.69 | HPGD (0.56) | FLT4KDRHPGDNPSR1DAPK1 | |
| SCHEMBL8465881 | 0.68 | ADORA2A (0.56) | FLT4KDRHPGDTAAR1TSHR | |
| SCHEMBL4379586 | 0.67 | ADORA1 (0.56) | FLT4KDRHPGDTAAR1ALDH1A1 | |
| SCHEMBL14659198 | 0.67 | FLT4 (0.51) | FLT4KDRHPGDDAPK1HTT |
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-2145888-A1 | Deazapurine derivatives as HSP90-Inhibitors | Conforma Therapeutics Corporation (US) | 2010-01-20 | — | — | EP | disclosed |
| EP-1670802-A2 | NOVEL HETEROCYCLIC COMPOUNDS AS HSP90-INHIBITORS | Conforma Therapeutic Corporation (US) | 2006-06-21 | — | — | EP | disclosed |
| WO-2005028434-A2 | NOVEL HETEROCYCLIC COMPOUNDS AS HSP90-INHIBITORS | CONFORMA THERAPEUTICS CORPORATION (US) | 2005-03-31 | — | — | WO | disclosed |