Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 1/20 | 0.41 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.36 |
| ▸ | PGK1 | P00558 | 1/20 | 0.33 |
| ▸ | PGK2 | P07205 | 1/20 | 0.33 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.31 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.31 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.31 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.31 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.31 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
| ▸ | MPO | P05164 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL19605335 | 0.81 | PARP1 (0.38) | PGK1PGK2HRH4GRIN2DGRIN3B | |
| SCHEMBL486201 | 0.78 | CCR1 (0.55) | CCR1PGK1PGK2HRH4GRIN2D | |
| SCHEMBL20067383 | 0.78 | ENPP2 (0.36) | ENPP2 | |
| SCHEMBL20052269 | 0.76 | CCR4 (0.33) | NPSR1 | |
| SCHEMBL28111002 | 0.76 | CCR1 (0.52) | CCR1PGK1PGK2HRH4GRIN2D | |
| SCHEMBL31139482 | 0.72 | CCR1 (0.40) | CCR1ENPP2 | |
| SCHEMBL16588099 | 0.72 | CCR1 (0.48) | CCR1PGK1PGK2HRH4GRIN2D | |
| SCHEMBL9145225 | 0.70 | CCR1 (0.46) | CCR1PGK1PGK2HRH4GRIN2D | |
| SCHEMBL29956196 | 0.70 | ENPP2 (0.34) | ENPP2 | |
| SCHEMBL1836255 | 0.70 | — | — |
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 |