Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIA1 | P42261 | 2/20 | 0.52 |
| ▸ | GRIA2 | P42262 | 2/20 | 0.52 |
| ▸ | GRIA3 | P42263 | 2/20 | 0.52 |
| ▸ | GRIA4 | P48058 | 2/20 | 0.52 |
| ▸ | PARP1 | P09874 | 2/20 | 0.47 |
| ▸ | DAO | P14920 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.43 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.43 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.43 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.43 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.43 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | G6PD | P11413 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL26352125 | 0.84 | GRIA1 (0.51) | GRIA1GRIA2GRIA3GRIA4PARP1 | |
| SCHEMBL444120 | 0.81 | DAO (0.58) | DAOPOLB | |
| Hydrochloric Acid SCHEMBL7428616 | 0.80 | DAO (0.56) | DAOPOLB | |
| SCHEMBL7349965 | 0.76 | DAO (0.66) | GRIA1GRIA2GRIA3GRIA4PARP1 | |
| SCHEMBL31653996 | 0.75 | GRIA1 (0.63) | GRIA1GRIA2GRIA3GRIA4PARP1 | |
| SCHEMBL4704936 | 0.75 | GRIA1 (0.63) | GRIA1GRIA2GRIA3GRIA4PARP1 | |
| SCHEMBL30910102 | 0.73 | PDE7A (0.51) | GRIA1GRIA2GRIA3GRIA4PARP1 | |
| SCHEMBL3150851 | 0.73 | PDE7A (0.51) | GRIA1GRIA2GRIA3GRIA4PARP1 | |
| SCHEMBL24335141 | 0.73 | GRIA1 (0.41) | GRIA1GRIA2GRIA3GRIA4PARP1 | |
| SCHEMBL7779726 | 0.72 | GRIA1 (0.47) | GRIA1GRIA2GRIA3GRIA4PARP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102656163-B | Suppress the heterogeneous ring compound of PASK | BIOENERGENIX (US) | 2016-01-13 | — | — | CN | disclosed |