Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | RARB | P10826 | 4/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | PLK1 | P53350 | 1/20 | 0.40 |
| ▸ | PLA2G4B | P0C869 | 2/20 | 0.39 |
| ▸ | THRA | P10827 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7929627 | 0.88 | NR1I2 (0.47) | NR1I2GAARARBL3MBTL1TP53 | |
| SCHEMBL19881701 | 0.77 | NR1I2 (0.51) | NR1I2GAARARBL3MBTL1TP53 | |
| SCHEMBL5675150 | 0.75 | NR1I2 (0.43) | NR1I2GAARARBL3MBTL1 | |
| SCHEMBL5419941 | 0.75 | NR1I2 (0.56) | NR1I2GAARARBL3MBTL1TP53 | |
| SCHEMBL5897070 | 0.74 | GAA (0.50) | NR1I2GAA | |
| SCHEMBL249452 | 0.73 | GAA (0.57) | NR1I2GAARARBL3MBTL1TP53 | |
| Alcohol SCHEMBL28846453 | 0.72 | NR1I2 (0.56) | NR1I2GAARARBL3MBTL1TP53 | |
| SCHEMBL36443 | 0.71 | GAA (0.56) | NR1I2GAARARBL3MBTL1TP53 | |
| SCHEMBL17921592 | 0.71 | GAA (0.56) | NR1I2GAARARBL3MBTL1TP53 | |
| SCHEMBL27025553 | 0.71 | GAA (0.56) | NR1I2GAARARBL3MBTL1TP53 |
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-6204306-B1 | ALPHA-AMINOACETOPHENONES FUNCTIONALIZED WITH ORGANIC DIISOCYANATES, WHICH CAN BE USED AS REACTIVE PHOTOINITIATORS; | NOVARTIS AG (CH) | 2001-03-20 | — | — | US | disclosed |