Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | GRIN1 | Q05586 | 12/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 12/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13521574 | 0.84 | TP53 (0.44) | GRIN1GRIN2BMAPTMEN1KMT2A | |
| SCHEMBL3114848 | 0.83 | GRIN1 (0.43) | GRIN1GRIN2BMAPT | |
| SCHEMBL3129349 | 0.83 | GRIN1 (0.48) | CYP1A2CYP2D6CYP2C19GRIN1GRIN2B | |
| SCHEMBL3118576 | 0.82 | CES2 (0.49) | GRIN1GRIN2BPOLBMAPT | |
| SCHEMBL13521724 | 0.80 | MAPT (0.49) | GRIN1GRIN2BALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL13521623 | 0.79 | GRIN1 (0.49) | GRIN1GRIN2BHTTHPGDPOLB | |
| SCHEMBL13521710 | 0.79 | GRIN1 (0.53) | GRIN1GRIN2BPOLB | |
| SCHEMBL3129279 | 0.79 | KMT2A (0.50) | ALDH1A1HTTSMN1; SMN2KDM4EPOLB | |
| SCHEMBL3123200 | 0.79 | ADORA2B (0.39) | GRIN1GRIN2BHTTMAPT | |
| SCHEMBL13521599 | 0.79 | GRIN1 (0.44) | GRIN1GRIN2BPOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010008777-A2 | FUSED AZABICYCLIC PYRIDINES | LIGAND PHARMACEUTICALS INC. (US) | 2010-01-21 | — | — | WO | claimed |