Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 4/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | BRD4 | O60885 | 1/20 | 0.30 |
| ▸ | LIN28A | Q9H9Z2 | 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 | |
|---|---|---|---|---|
| SCHEMBL1148637 | 0.84 | HSP90AA1 (0.40) | ESR1ESR2HSP90AA1HSP90AB1RAB9A | |
| SCHEMBL14218367 | 0.79 | ALDH1A1 (0.36) | HSP90AA1HSP90AB1ALOX15MEN1KMT2A | |
| SCHEMBL16604235 | 0.77 | HSP90AA1 (0.59) | HSP90AA1HSP90AB1 | |
| SCHEMBL4472095 | 0.73 | MAPT (0.35) | ESR1ESR2LMNAMAPTHTT | |
| SCHEMBL1148698 | 0.73 | HSP90AA1 (0.50) | ESR1ESR2HSP90AA1HSP90AB1RAB9A | |
| SCHEMBL3973501 | 0.72 | KDM4E (0.34) | ESR1ESR2RAB9AMEN1KMT2A | |
| SCHEMBL1148726 | 0.70 | ALDH1A1 (0.42) | HSP90AA1HSP90AB1RAB9AMEN1KMT2A | |
| SCHEMBL14453299 | 0.69 | MEN1 (0.36) | HSP90AA1HSP90AB1MEN1KMT2AALDH1A1 | |
| SCHEMBL14456174 | 0.67 | LMNA (0.36) | MEN1KMT2AALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL1148553 | 0.65 | ALDH1A1 (0.38) | HSP90AA1HSP90AB1RAB9AMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1928846-A2 | TRIAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY | Synta Pharmaceuticals Corporation (US) | 2008-06-11 | — | — | EP | disclosed |
| WO-2007094819-A2 | TRIAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY | SYNTA PHARMACEUTICALS CORP. (US) | 2007-08-23 | — | — | WO | disclosed |