Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90B1 | P14625 | 6/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 5/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16768667 | 0.87 | HSP90AA1 (0.47) | HSP90B1HSP90AA1TP53LMNANPC1 | |
| SCHEMBL16768686 | 0.87 | HSP90AA1 (0.47) | HSP90B1HSP90AA1LMNAHSP90AB1 | |
| SCHEMBL16133647 | 0.87 | HSP90B1 (0.56) | HSP90B1HSP90AA1POLBTP53MAPT | |
| SCHEMBL16768665 | 0.86 | HSP90AA1 (0.51) | HSP90B1HSP90AA1POLBNPC1RAB9A | |
| SCHEMBL16136340 | 0.83 | SMN1; SMN2 (0.59) | HSP90B1HSP90AA1POLBNPC1RAB9A | |
| SCHEMBL16768651 | 0.81 | HSP90AA1 (0.46) | HSP90B1HSP90AA1HSP90AB1 | |
| SCHEMBL16768685 | 0.78 | HSP90AA1 (0.50) | HSP90B1HSP90AA1TP53NPC1RAB9A | |
| SCHEMBL16133636 | 0.77 | HSP90B1 (0.53) | HSP90B1CYP1A2CYP2D6CYP2C19HSP90AA1 | |
| SCHEMBL29136621 | 0.74 | AGTR1 (0.55) | HSP90B1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL16133645 | 0.74 | HSP90B1 (0.52) | HSP90B1HSP90AA1TP53LMNANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9776996-B2 | Substituted 6,5-fused bicyclic heteroaryl compounds | Epizyme, Inc. (US) | 2017-10-03 | — | — | US | disclosed |
| US-9045477-B2 | Substituted 6,5-fused bicyclic heteroaryl compounds | Epizyme, Inc. (US) | 2015-06-02 | — | — | US | disclosed |