Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | PDE3B | Q13370 | 7/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 7/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.38 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.38 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.38 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 3/20 | 0.36 |
| ▸ | CDK2 | P24941 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4094512 | 0.77 | MEN1 (0.47) | MEN1KMT2ANPC1PDE3BPDE3A | |
| Water SCHEMBL9036802 | 0.75 | MEN1 (0.46) | MEN1KMT2ANPC1PDE3BPDE3A | |
| SCHEMBL1711296 | 0.68 | CYP3A4 (0.53) | PDE3BPDE3AKDM4EMAOAALDH1A1 | |
| SCHEMBL29368836 | 0.68 | CYP3A4 (0.53) | PDE3BPDE3AKDM4EMAOAALDH1A1 | |
| SCHEMBL3436884 | 0.66 | ALDH1A1 (0.37) | MEN1KMT2ANPC1KDM4EMAOA | |
| SCHEMBL7455184 | 0.65 | NPC1 (0.59) | MEN1KMT2ANPC1PDE3BPDE3A | |
| SCHEMBL24000179 | 0.64 | GRIN2D (0.54) | PDE3BPDE3AKDM4EMAOAALDH1A1 | |
| SCHEMBL30088998 | 0.64 | GRIN2D (0.54) | PDE3BPDE3AKDM4EMAOAALDH1A1 | |
| SCHEMBL8856580 | 0.64 | PTGS2 (0.47) | MEN1KMT2AKDM4EALDH1A1HPGD | |
| Water SCHEMBL9036576 | 0.62 | PTGS2 (0.46) | MEN1KMT2AKDM4EALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-115108987-A | N-substituted indenoisoquinolinone derivative and preparation method thereof | 华侨大学 | 2022-09-27 | — | — | CN | claimed |
| CN-115108987-A | N-substituted indenoisoquinolinone derivative and preparation method thereof | 华侨大学 | 2022-09-27 | — | — | CN | disclosed |