Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | PGK1 | P00558 | 1/20 | 0.38 |
| ▸ | PGK2 | P07205 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.37 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.36 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.36 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.36 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15725241 | 0.80 | NPSR1 (0.43) | NPSR1ALDH1A1POLBKDM4ESMN1; SMN2 | |
| Methacrylic Acid SCHEMBL28898688 | 0.79 | NPSR1 (0.46) | NPSR1PGK1PGK2KCNH2HRH4 | |
| SCHEMBL6900384 | 0.78 | P2RX7 (0.46) | NPSR1NOS2ALDH1A1POLBP2RX7 | |
| SCHEMBL522024 | 0.78 | HRH4 (0.46) | NPSR1PGK1PGK2KCNH2HRH4 | |
| SCHEMBL26046013 | 0.77 | NPSR1 (0.43) | NPSR1PGK1PGK2KCNH2ALDH1A1 | |
| SCHEMBL20202796 | 0.77 | NPSR1 (0.43) | NPSR1PGK1PGK2ALDH1A1CYP1A2 | |
| SCHEMBL27960125 | 0.77 | NPSR1 (0.43) | NPSR1PGK1PGK2KCNH2ALDH1A1 | |
| SCHEMBL6564804 | 0.77 | NPSR1 (0.43) | NPSR1PGK1PGK2KCNH2ALDH1A1 | |
| SCHEMBL3184758 | 0.77 | ALDH1A1 (0.46) | NPSR1ALDH1A1CYP1A2TSHRSMN1; SMN2 | |
| SCHEMBL31715510 | 0.77 | NPSR1 (0.43) | NPSR1PGK1PGK2KCNH2ALDH1A1 |
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-2015143340-A1 | COMPOUNDS AND THEIR METHODS OF USE | AGIOS PHARMACEUTICALS, INC. (US) | 2015-09-24 | — | — | WO | disclosed |