Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM6B | O15054 | 1/20 | 0.41 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.41 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.41 |
| ▸ | TLR8 | Q9NR97 | 4/20 | 0.38 |
| ▸ | TLR7 | Q9NYK1 | 3/20 | 0.38 |
| ▸ | BDKRB1 | P46663 | 3/20 | 0.37 |
| ▸ | UTS2R | Q9UKP6 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | ATR | Q13535 | 1/20 | 0.36 |
| ▸ | PDE5A | O76074 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5532789 | 0.79 | BDKRB1 (0.40) | BDKRB1ATRPSMD14KDM4EALDH1A1 | |
| SCHEMBL5153911 | 0.78 | RIPK1 (0.42) | KDM6BKDM4CRIPK1TLR8TLR7 | |
| SCHEMBL7437816 | 0.73 | ALDH1A1 (0.59) | RIPK1TLR8TLR7BDKRB1KDM4E | |
| SCHEMBL5176735 | 0.73 | RIPK1 (0.40) | KDM6BKDM4CRIPK1TLR8TLR7 | |
| SCHEMBL5159393 | 0.69 | TLR8 (0.42) | RIPK1TLR8TLR7CYP3A4KDM4E | |
| SCHEMBL11604657 | 0.68 | ALDH1A1 (0.46) | RIPK1BDKRB1KDM4EALDH1A1HPGD | |
| SCHEMBL12723401 | 0.67 | RIPK1 (0.47) | KDM6BKDM4CRIPK1CYP3A4KDM4E | |
| SCHEMBL28672732 | 0.67 | KDM4E (0.71) | RIPK1KDM4EALDH1A1GLAGAA | |
| SCHEMBL5158855 | 0.66 | KDM4C (0.56) | KDM6BKDM4CTLR8KDM4EGAA | |
| SCHEMBL166442 | 0.66 | KDM4E (0.43) | KDM4EALDH1A1GLAGAAHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1740575-A2 | PYRROLIDINE DERIVATIVES USEFUL AS BACE INHIBITORS | ELI LILLY AND COMPANY (US) | 2007-01-10 | — | — | EP | disclosed |
| WO-2005108358-A2 | PYRROLIDINE DERIVATIVES USEFUL AS BACE INHIBITORS | ELI LILLY AND COMPANY (US) | 2005-11-17 | — | — | WO | disclosed |