Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.39 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | CASP1 | P29466 | 2/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | TTK | P33981 | 1/20 | 0.39 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.39 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | HPGD | P15428 | 4/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28359047 | 0.82 | AURKA (0.47) | NPY5RMAPTAURKATTKAURKB | |
| SCHEMBL29635205 | 0.82 | AURKA (0.47) | NPY5RMAPTAURKATTKAURKB | |
| SCHEMBL28358921 | 0.73 | CRHBP (0.51) | MAPTALDH1A1HSD17B10XDHNPC1 | |
| SCHEMBL6194760 | 0.72 | PARP1 (0.46) | MAPTMEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL3006008 | 0.71 | NPY5R (0.51) | PDE4APDE4BPDE4CPDE4DPDE3B | |
| SCHEMBL10492510 | 0.71 | MAPT (0.50) | PDE4APDE4BPDE4CPDE4DPDE3B | |
| SCHEMBL31078313 | 0.71 | HRH4 (0.46) | ALDH1A1HPGDGAAHTTLMNA | |
| SCHEMBL28796378 | 0.71 | CYP2A6 (0.37) | HPGDLMNACYP2A6KEAP1 | |
| SCHEMBL5797966 | 0.69 | PTGS2 (0.60) | MAPTMEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL6960951 | 0.68 | PDE4A (0.44) | PDE4APDE4BPDE4CPDE4DPDE3B |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110818609-A | Preparation method and application of 3-acetyl indole BRPF1 inhibitor | 中国药科大学 | 2020-02-21 | — | — | CN | disclosed |