Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 5/20 | 0.42 |
| ▸ | ITGA4 | P13612 | 5/20 | 0.42 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.32 |
| ▸ | XDH | P47989 | 1/20 | 0.32 |
| ▸ | PPID | Q08752 | 2/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | HTR1D | P28221 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HTR7 | P34969 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | HTR5A | P47898 | 1/20 | 0.31 |
| ▸ | HTR6 | P50406 | 1/20 | 0.31 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.31 |
| ▸ | BACE1 | P56817 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4735581 | 0.89 | ITGB1 (0.46) | ITGB1ITGA4ELANE | |
| SCHEMBL4750224 | 0.85 | ITGB1 (0.44) | ITGB1ITGA4ELANENLRP3PPID | |
| SCHEMBL4750220 | 0.85 | ITGB1 (0.44) | ITGB1ITGA4ELANENLRP3PPID | |
| SCHEMBL4735983 | 0.84 | ITGA4 (0.47) | ITGB1ITGA4ELANE | |
| SCHEMBL4736967 | 0.84 | TDP1 (0.44) | ITGB1ITGA4ALDH1A1 | |
| SCHEMBL4732361 | 0.83 | KCNQ2 (0.39) | ITGB1ITGA4PPID | |
| SCHEMBL3832796 | 0.82 | ITGB1 (0.47) | ITGB1ITGA4ELANE | |
| SCHEMBL3835880 | 0.81 | ITGB1 (0.46) | ITGB1ITGA4ELANENLRP3ALDH1A1 | |
| SCHEMBL4733784 | 0.80 | MAPT (0.52) | ITGB1ITGA4ALDH1A1 | |
| SCHEMBL4739188 | 0.79 | ITGB1 (0.45) | ITGB1ITGA4ELANE |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008064830-A1 | BICYCLIC AND HETEROBICYCLIC DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR PHARMACEUTICAL USES | UCB PHARMA, S.A. (BE) | 2008-06-05 | — | — | WO | claimed |
| WO-2008064830-A1 | BICYCLIC AND HETEROBICYCLIC DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR PHARMACEUTICAL USES | UCB PHARMA, S.A. (BE) | 2008-06-05 | — | — | WO | disclosed |