Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FBP1 | P09467 | 1/20 | 0.43 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.42 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.42 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.42 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.41 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.41 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.41 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.41 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.40 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6867023 | 0.81 | GRIN2B (0.47) | FBP1MAOBMAOAGRIN2DGRIN3B | |
| SCHEMBL6866815 | 0.79 | CYP1A1 (0.52) | NFE2L2KDM4EALDH1A1POLBPKM | |
| SCHEMBL1763184 | 0.79 | MAPT (0.53) | FBP1KCNQ3KCNQ2KCNE1KCNQ1 | |
| SCHEMBL1763181 | 0.79 | MAPT (0.53) | FBP1KCNQ3KCNQ2KCNE1KCNQ1 | |
| SCHEMBL15646471 | 0.69 | KCNQ3 (0.60) | KCNQ3KCNQ2KCNE1KCNQ1NAPRT | |
| SCHEMBL12446116 | 0.67 | GRIN1 (0.43) | FBP1MAOBGRIN2DGRIN3BGRIN1 | |
| SCHEMBL8923931 | 0.65 | CYP1B1 (0.49) | MAOBGRIN1GRIN2BALDH1A1POLB | |
| SCHEMBL7575017 | 0.65 | GRIN1 (0.47) | FBP1MAOBGRIN2DGRIN3BGRIN1 | |
| SCHEMBL28459287 | 0.65 | MAPT (0.56) | FBP1MAOBMAOAGRIN2DGRIN3B | |
| SCHEMBL388168 | 0.64 | NAPRT (0.67) | KCNQ3KCNQ2KCNE1KCNQ1NAPRT |
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-2011061139-A1 | SUBSTITUTED PYRROLIDINE-2-CARBOXAMIDES | F. HOFFMANN-LA ROCHE AG (CH) | 2011-05-26 | — | — | WO | disclosed |