Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.51 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.46 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.43 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | 0.89 | HSP90AA1 (0.47) | HSP90AA1HSP90B1AGTR1AGTR2NPC1 | |
| SCHEMBL16768686 | 0.89 | HSP90AA1 (0.47) | HSP90AA1HSP90AB1HSP90B1ADRB1SMN1; SMN2 | |
| SCHEMBL16768651 | 0.89 | HSP90AA1 (0.46) | HSP90AA1HSP90AB1HSP90B1HDAC1HPGD | |
| SCHEMBL16768685 | 0.86 | HSP90AA1 (0.50) | HSP90AA1HSP90AB1HSP90B1NPC1RAB9A | |
| SCHEMBL16768673 | 0.86 | HSP90B1 (0.51) | HSP90AA1HSP90AB1HSP90B1KMT2APOLB | |
| SCHEMBL16133631 | 0.85 | POLB (0.52) | HSP90AA1HSP90AB1HSP90B1MEN1KMT2A | |
| SCHEMBL16136314 | 0.81 | HSP90AA1 (0.54) | HSP90AA1HSP90AB1HSP90B1AGTR1AGTR2 | |
| SCHEMBL10178199 | 0.80 | HSP90AA1 (0.51) | HSP90AA1HSP90AB1HSP90B1MEN1KMT2A | |
| SCHEMBL16768694 | 0.76 | NAMPT (0.40) | MEN1KMT2A | |
| SCHEMBL16064991 | 0.76 | HSP90AA1 (0.53) | HSP90AA1HSP90AB1HSP90B1AGTR1AGTR2 |
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 |