Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 5/20 | 0.40 |
| ▸ | NOS2 | P35228 | 5/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | NOS1 | P29475 | 2/20 | 0.35 |
| ▸ | CCR1 | P32246 | 1/20 | 0.33 |
| ▸ | CCR5 | P51681 | 1/20 | 0.33 |
| ▸ | CCR8 | P51685 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
| ▸ | GABRP | O00591 | 1/20 | 0.32 |
| ▸ | GABRD | O14764 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18340930 | 0.80 | NOS2 (0.52) | NOS3NOS2KDM4EKMT2AMEN1 | |
| SCHEMBL29953880 | 0.77 | CCR1 (0.36) | NOS3NOS2CCR1CCR5CCR8 | |
| SCHEMBL539587 | 0.77 | CCR1 (0.36) | NOS3NOS2CCR1CCR5CCR8 | |
| SCHEMBL21710320 | 0.77 | NOS3 (0.34) | NOS3NOS2KDM4EKMT2AMEN1 | |
| SCHEMBL29953634 | 0.76 | CCR1 (0.34) | KDM4EKMT2AMEN1CCR1CCR5 | |
| SCHEMBL29951878 | 0.74 | CCR1 (0.33) | KDM4ECCR1CCR5CCR8CYP2A6 | |
| SCHEMBL22445373 | 0.74 | CCR1 (0.33) | KMT2ACCR1CCR5CCR8CYP2A6 | |
| SCHEMBL1181840 | 0.74 | NOS2 (0.56) | NOS3NOS2KDM4EKMT2AMEN1 | |
| SCHEMBL27082950 | 0.74 | CCR1 (0.33) | KDM4ECCR1CCR5CCR8CYP2A6 | |
| SCHEMBL19899743 | 0.73 | — | — |
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 |