Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 2/20 | 0.36 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | LTA4H | P09960 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.30 |
| ▸ | METAP2 | P50579 | 1/20 | 0.30 |
| ▸ | METAP1 | P53582 | 1/20 | 0.30 |
| ▸ | SLC7A5 | Q01650 | 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 | |
|---|---|---|---|---|
| SCHEMBL1817104 | 0.89 | NOS1 (0.40) | NOS1NOS3NOS2HDAC3HDAC1 | |
| SCHEMBL1817108 | 0.89 | NOS1 (0.40) | NOS1NOS3NOS2HDAC3HDAC1 | |
| SCHEMBL1274850 | 0.89 | NOS1 (0.40) | NOS1NOS3NOS2HDAC3HDAC1 | |
| Hydrochloric Acid SCHEMBL16798190 | 0.87 | NOS1 (0.39) | NOS1NOS3NOS2HDAC3HDAC1 | |
| Hydrochloric Acid SCHEMBL23510221 | 0.87 | NOS1 (0.39) | NOS1NOS3NOS2HDAC3HDAC1 | |
| Hydrochloric Acid SCHEMBL15608414 | 0.87 | NOS1 (0.39) | NOS1NOS3NOS2HDAC3HDAC1 | |
| SCHEMBL16574584 | 0.84 | KIF11 (0.40) | METAP2METAP1 | |
| SCHEMBL8975399 | 0.82 | KIF11 (0.41) | NOS1NOS3NOS2CYP2C19SLC7A5 | |
| SCHEMBL8412082 | 0.82 | METAP2 (0.30) | METAP2METAP1 | |
| SCHEMBL15201168 | 0.82 | KIF11 (0.41) | NOS1NOS3NOS2CYP2C19SLC7A5 |
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-2022126275-A1 | RADIOLABELED COMPOUNDS TARGETING THE PROSTATE-SPECIFIC MEMBRANE ANTIGEN | THE UNIVERSITY OF BRITISH COLUMBIA (CA) | 2022-06-23 | — | — | WO | disclosed |