Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 4/20 | 0.56 |
| ▸ | YTHDC1 | Q96MU7 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | GLA | P06280 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | CDK2 | P24941 | 2/20 | 0.42 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.42 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.42 |
| ▸ | NSD3 | Q9BZ95 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | IKBKB | O14920 | 1/20 | 0.39 |
| ▸ | CHUK | O15111 | 1/20 | 0.39 |
| ▸ | PLK1 | P53350 | 1/20 | 0.39 |
| ▸ | BTK | Q06187 | 1/20 | 0.39 |
| ▸ | ITK | Q08881 | 1/20 | 0.39 |
| ▸ | IKBKE | Q14164 | 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 | |
|---|---|---|---|---|
| SCHEMBL28295500 | 0.83 | MAPK14 (0.49) | CDK1CDK2NSD3MAPTIKBKB | |
| SCHEMBL14296964 | 0.82 | CCNE2 (0.59) | CDK1YTHDC1KDM4EALDH1A1CDK2 | |
| SCHEMBL27029467 | 0.81 | CDK1 (0.46) | CDK1YTHDC1 | |
| SCHEMBL29931559 | 0.81 | CDK1 (0.46) | CDK1YTHDC1 | |
| SCHEMBL22587405 | 0.81 | CDK1 (0.58) | CDK1KDM4EALDH1A1LMNAGLA | |
| SCHEMBL16688834 | 0.80 | CDK1 (0.50) | CDK1YTHDC1ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL14891975 | 0.80 | CDK1 (0.57) | CDK1YTHDC1CDK2CCNE2CCNE1 | |
| SCHEMBL25213159 | 0.79 | TEAD1 (0.54) | CDK1YTHDC1CDK2CCNE2CCNE1 | |
| SCHEMBL18656901 | 0.78 | ALDH1A1 (0.44) | CDK1YTHDC1KDM4EALDH1A1LMNA | |
| SCHEMBL31566321 | 0.77 | CDK1 (0.48) | CDK1YTHDC1CDK2CCNE2CCNE1 |
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-118515713-A | Iridium (III) complex photosensitizer based on purine ligand, preparation method and application | 四川大学 | 2024-08-20 | — | — | CN | disclosed |