Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 11/20 | 0.76 |
| ▸ | HSP90AB1 | P08238 | 3/20 | 0.76 |
| ▸ | EGFR | P00533 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | SPR | P35270 | 1/20 | 0.42 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.41 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.41 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3094214 | 0.90 | HSP90AA1 (0.73) | HSP90AA1HSP90AB1SMN1; SMN2SPRTAS1R3 | |
| SCHEMBL16628709 | 0.88 | HSP90AA1 (0.80) | HSP90AA1HSP90AB1SMN1; SMN2KDM4ELMNA | |
| SCHEMBL3093783 | 0.88 | HSP90AA1 (0.77) | HSP90AA1HSP90AB1MAOBHTT | |
| SCHEMBL16628686 | 0.86 | HSP90AA1 (1.00) | HSP90AA1HSP90AB1SMN1; SMN2MAOB | |
| SCHEMBL12199647 | 0.86 | HSP90AA1 (0.73) | HSP90AA1HSP90AB1SMN1; SMN2KDM4ELMNA | |
| SCHEMBL16628804 | 0.85 | HSP90AA1 (0.76) | HSP90AA1HSP90AB1SMN1; SMN2TAS1R3TAS1R1 | |
| SCHEMBL12199578 | 0.85 | HSP90AA1 (1.00) | HSP90AA1HSP90AB1SMN1; SMN2KDM4ELMNA | |
| SCHEMBL903930 | 0.85 | HSP90AA1 (0.76) | HSP90AA1HSP90AB1SMN1; SMN2KDM4ELMNA | |
| SCHEMBL3085489 | 0.85 | HSP90AA1 (0.76) | HSP90AA1HSP90AB1SMN1; SMN2KDM4EHTT | |
| SCHEMBL3095799 | 0.85 | HSP90AA1 (0.76) | HSP90AA1HSP90AB1SMN1; SMN2KDM4EHTT |
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-2164833-B1 | Quinazolinamide derivatives useful for the treatment of tumour diseases | MERCK PATENT GMBH (DE) | 2015-04-15 | — | — | EP | claimed |
| EP-2164833-B1 | Quinazolinamide derivatives useful for the treatment of tumour diseases | MERCK PATENT GMBH (DE) | 2015-04-15 | — | — | EP | disclosed |