Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERCC1 | P07992 | 2/20 | 0.35 |
| ▸ | ERCC4 | Q92889 | 2/20 | 0.35 |
| ▸ | FEN1 | P39748 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL2206687 | 0.88 | NPSR1 (0.32) | ERCC1ERCC4FEN1 | |
| SCHEMBL2208054 | 0.66 | KCNH2 (0.58) | ERCC1ERCC4FEN1KCNH2CYP2C9 | |
| SCHEMBL5757341 | 0.66 | CYP2C9 (0.38) | ERCC1ERCC4FEN1KCNH2CYP2C9 | |
| SCHEMBL2202249 | 0.65 | ALDH1A1 (0.43) | ERCC1ERCC4FEN1KCNH2CYP2C9 | |
| SCHEMBL12529315 | 0.60 | ALDH1A1 (0.36) | KCNH2 | |
| SCHEMBL13672437 | 0.60 | NPSR1 (0.36) | ERCC1ERCC4FEN1 | |
| SCHEMBL12471410 | 0.59 | ERCC1 (0.54) | ERCC1ERCC4FEN1 | |
| SCHEMBL5528388 | 0.58 | ERCC1 (0.33) | ERCC1ERCC4FEN1 | |
| SCHEMBL5336044 | 0.58 | MAPT (0.37) | ERCC1ERCC4FEN1 | |
| SCHEMBL13815129 | 0.57 | F10 (0.35) | — |
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-1866313-A1 | HIV INTEGRASE INHIBITORS | Istituto di Richerche di Biologia Molecolare P. Angeletti S.p.A. (IT) | 2007-12-19 | — | — | EP | disclosed |
| WO-2006103399-A1 | HIV INTEGRASE INHIBITORS | ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) | 2006-10-05 | — | — | WO | disclosed |