Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 2/20 | 0.39 |
| ▸ | BUB1 | O43683 | 15/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19100171 | 0.79 | RPS6KA5 (0.41) | KDM4ESMN1; SMN2RPS6KA5 | |
| SCHEMBL28743620 | 0.78 | GAA (0.48) | KDM4EALDH1A1LMNAHPGDHTT | |
| SCHEMBL19100629 | 0.75 | RPS6KA5 (0.39) | KMT2ARPS6KA5 | |
| SCHEMBL19600365 | 0.72 | PDE5A (0.54) | PDE5ABUB1KDM4EALDH1A1LMNA | |
| SCHEMBL30976735 | 0.71 | BUB1 (0.36) | PDE5ABUB1 | |
| SCHEMBL30725494 | 0.71 | MAP2K4 (0.41) | KDM4EALDH1A1RPS6KA5 | |
| SCHEMBL16653684 | 0.71 | MAP2K4 (0.41) | KDM4EALDH1A1RPS6KA5 | |
| SCHEMBL29037889 | 0.69 | BRD4 (0.37) | — | |
| SCHEMBL29520186 | 0.69 | BRD4 (0.37) | — | |
| SCHEMBL30976681 | 0.68 | BUB1 (0.38) | BUB1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022063140-A1 | PYRIMIDINE AND PYRIDINE DERIVATIVES AS HPK1 MODULATOR AND METHODS USING SAME | SHENZHEN IONOVA LIFE SCIENCE CO., LTD. (CN) | 2022-03-31 | — | — | WO | disclosed |