Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.34 |
| ▸ | ERN1 | O75460 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3586689 | 1.00 | IDO1 (0.34) | IDO1ERN1CES2CES1 | |
| SCHEMBL14919625 | 0.88 | IDO1 (0.33) | IDO1 | |
| SCHEMBL1359177 | 0.83 | ERN1 (0.39) | ERN1CES2CES1 | |
| SCHEMBL26094636 | 0.80 | CA9 (0.33) | IDO1 | |
| SCHEMBL30905965 | 0.78 | NPC1 (0.31) | — | |
| SCHEMBL26367108 | 0.78 | NMT1 (0.32) | — | |
| SCHEMBL23272957 | 0.74 | CA9 (0.41) | ERN1CES2CES1 | |
| SCHEMBL29956440 | 0.74 | CA9 (0.41) | ERN1CES2CES1 | |
| SCHEMBL22288242 | 0.74 | TAAR1 (0.39) | — | |
| SCHEMBL25379993 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |