Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.50 |
| ▸ | PARP3 | Q9Y6F1 | 2/20 | 0.50 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.50 |
| ▸ | TNKS | O95271 | 4/20 | 0.35 |
| ▸ | TNKS2 | Q9H2K2 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | WNT3A | P56704 | 1/20 | 0.33 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.33 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.33 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.33 |
| ▸ | AXIN2 | Q9Y2T1 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL29941595 | 0.71 | PARP1 (0.41) | PARP1PARP3PARP15TNKSTNKS2 | |
| SCHEMBL13153128 | 0.70 | KDM4E (0.63) | KDM4EACHE | |
| SCHEMBL421328 | 0.67 | PARP1 (1.00) | PARP1PARP3PARP15TNKSTNKS2 | |
| SCHEMBL7706330 | 0.67 | SMN1; SMN2 (0.35) | KDM4E | |
| SCHEMBL16479770 | 0.63 | PDK1 (0.39) | PARP1TNKS2KDM4EPARP2HTR2A | |
| SCHEMBL22727894 | 0.63 | CYP2C19 (0.51) | KDM4E | |
| SCHEMBL30870656 | 0.62 | PARP1 (0.40) | PARP1PARP3PARP15TNKSTNKS2 | |
| SCHEMBL9583329 | 0.62 | ACHE (0.67) | PARP1PARP3PARP15KDM4EACHE | |
| SCHEMBL20783851 | 0.61 | — | — | |
| SCHEMBL7782055 | 0.61 | PARP1 (0.67) | PARP1PARP3PARP15TNKSTNKS2 |
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-2023007185-A1 | IMIDAZOLE ORGANIC COMPOUNDS AND THEIR USE AGAINST INFLAMMATORY BOWEL DISEASE | Benevolentai Cambridge Limited (GB) | 2023-02-02 | — | — | WO | disclosed |