Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 3/20 | 0.51 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.48 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 6/20 | 0.45 |
| ▸ | RAB9A | P51151 | 5/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4687682 | 0.78 | EPHX2 (0.60) | EPHX2P2RX7AAK1NPC1RAB9A | |
| SCHEMBL4687186 | 0.77 | EPHX2 (0.58) | EPHX2P2RX7AAK1NPC1RAB9A | |
| SCHEMBL4690268 | 0.76 | EPHX2 (0.57) | EPHX2P2RX7AAK1NPC1RAB9A | |
| SCHEMBL4688109 | 0.76 | EPHX2 (0.57) | EPHX2P2RX7AAK1NPC1RAB9A | |
| SCHEMBL7159830 | 0.75 | P2RX7 (0.74) | EPHX2P2RX7AAK1NPC1RAB9A | |
| SCHEMBL4686987 | 0.75 | EPHX2 (0.56) | EPHX2P2RX7AAK1NPC1RAB9A | |
| SCHEMBL4688016 | 0.75 | EPHX2 (0.56) | EPHX2P2RX7AAK1NPC1RAB9A | |
| SCHEMBL4692647 | 0.72 | EPHX2 (0.63) | EPHX2P2RX7AAK1NPC1RAB9A | |
| SCHEMBL7923968 | 0.71 | ALDH1A1 (0.61) | TDP1ALDH1A1SMN1; SMN2KMT2AKDM4E | |
| SCHEMBL23004908 | 0.69 | ALDH1A1 (0.44) | EPHX2NPC1RAB9ATDP1ALDH1A1 |
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-2022099011-A1 | BICYCLIC 1,4-DIAZEPANONES AND THERAPEUTIC USES THEREOF | CYTOKINETICS, INC. (US) | 2022-05-12 | — | — | WO | disclosed |