Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NT5E | P21589 | 1/20 | 0.35 |
| ▸ | MBOAT4 | Q96T53 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.32 |
| ▸ | TUBB | P07437 | 1/20 | 0.32 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.32 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.32 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.32 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.32 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.32 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.32 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.32 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.32 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.32 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.32 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30971780 | 0.83 | PDE4B (0.39) | NT5EMBOAT4HSD17B10PDE4BCYP1A2 | |
| SCHEMBL2131813 | 0.83 | PDE4B (0.39) | NT5EMBOAT4HSD17B10PDE4BCYP1A2 | |
| SCHEMBL14844545 | 0.77 | MBOAT4 (0.37) | NT5EMBOAT4HSD17B10PDE4BCYP1A2 | |
| SCHEMBL2132119 | 0.75 | PRMT1 (0.43) | CYP1A2CYP2C9CYP2C19HPGDNPSR1 | |
| SCHEMBL2132111 | 0.75 | PRMT1 (0.43) | CYP1A2CYP2C9CYP2C19HPGDNPSR1 | |
| SCHEMBL24468866 | 0.74 | TRPV4 (0.32) | NT5E | |
| SCHEMBL12093699 | 0.74 | MBOAT4 (0.38) | MBOAT4HSD17B10PDE4BTUBB4ATUBB | |
| SCHEMBL2614964 | 0.74 | MBOAT4 (0.40) | MBOAT4HSD17B10PDE4BTUBB4ATUBB | |
| SCHEMBL19172629 | 0.73 | MBOAT4 (0.42) | MBOAT4HSD17B10PDE4BTUBB4ATUBB | |
| SCHEMBL15201463 | 0.73 | ULK1 (0.39) | NT5EMBOAT4HSD17B10PDE4BTUBB4A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3997096-A1 | NEW HETEROCYCLIC COMPOUNDS | F. Hoffmann-La Roche AG (CH) | 2022-05-18 | — | — | EP | disclosed |