Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | RAD52 | P43351 | 1/20 | 0.32 |
| ▸ | HTR7 | P34969 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | NPY1R | P25929 | 1/20 | 0.30 |
| ▸ | NPY2R | P49146 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL24528614 | 0.97 | RAD52 (0.32) | ALDH1A1LMNARAD52HTR7 | |
| SCHEMBL24528668 | 0.96 | RAD52 (0.32) | ALDH1A1LMNARAD52HTR7 | |
| SCHEMBL24528606 | 0.83 | ALDH1A1 (0.34) | ALDH1A1LMNAKDM4EMAPK1 | |
| SCHEMBL24528691 | 0.80 | PDE5A (0.35) | RAD52 | |
| SCHEMBL24528712 | 0.80 | ALDH1A1 (0.34) | ALDH1A1LMNAKDM4EHPGDNPSR1 | |
| SCHEMBL24528628 | 0.73 | ADORA2A (0.34) | ALDH1A1LMNARAD52POLBMAPK1 | |
| SCHEMBL24528664 | 0.71 | ADORA2A (0.34) | ALDH1A1LMNAKDM4E | |
| SCHEMBL24528512 | 0.70 | KDM4E (0.37) | ALDH1A1LMNARAD52KDM4ETHRB | |
| SCHEMBL29680746 | 0.70 | KDM4E (0.37) | ALDH1A1LMNARAD52KDM4ETHRB | |
| SCHEMBL24528631 | 0.70 | RAD52 (0.36) | ALDH1A1LMNARAD52KDM4EPOLB |
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-2022129376-A1 | 6-6 OR 5-6 FUSED BICYCLIC COMPOUNDS COMPRISING A PYRI(MI)DINE RING USEFUL IN THE|TREATMENT OF INFECTIOUS DISEASES | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) | 2022-06-23 | — | — | WO | disclosed |