Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 2/20 | 0.47 |
| ▸ | SMYD3 | Q9H7B4 | 5/20 | 0.45 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.41 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.40 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.40 |
| ▸ | TAS1R2 | Q8TE23 | 2/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL22468535 | 0.82 | ABL1 (0.49) | ABL1SMYD3MAPK14TAS1R3TAS1R1 | |
| SCHEMBL5494574 | 0.81 | ABL1 (0.48) | ABL1SMYD3MAPK14NPC1RAB9A | |
| SCHEMBL24958916 | 0.75 | ABL1 (0.53) | ABL1TAS1R3TAS1R1TAS1R2CNR1 | |
| SCHEMBL21602909 | 0.73 | PRKAB2 (0.45) | SMYD3MAPK14CNR1 | |
| SCHEMBL13146407 | 0.73 | MAPK14 (0.56) | MAPK14NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL178410 | 0.72 | CNR1 (0.52) | ABL1SMYD3MAPK14TAS1R3TAS1R1 | |
| SCHEMBL15820978 | 0.72 | SMYD3 (0.53) | SMYD3NPC1RAB9A | |
| SCHEMBL19661275 | 0.71 | HTR4 (0.51) | SMYD3NPC1RAB9A | |
| SCHEMBL24960094 | 0.70 | NPC1 (0.48) | ABL1SMYD3MAPK14NPC1TSHR | |
| SCHEMBL24956354 | 0.70 | SMYD3 (0.51) | ABL1SMYD3MAPK14NPC1RAB9A |
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 |