Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERCC1 | P07992 | 1/20 | 0.55 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.55 |
| ▸ | DRD3 | P35462 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.43 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4752588 | 0.94 | ERCC1 (0.49) | ERCC1ERCC4DRD3KCNH2HPGD | |
| SCHEMBL21382593 | 0.87 | LMNA (0.57) | ERCC1ERCC4KCNH2KMT2AMEN1 | |
| SCHEMBL21382534 | 0.84 | PRMT5 (0.47) | ALDH1A1SMN1; SMN2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL21382559 | 0.83 | GAA (0.49) | DRD3ALDH1A1SMN1; SMN2GRM2POLB | |
| SCHEMBL4751907 | 0.80 | SIGMAR1 (0.43) | ERCC1ERCC4DRD3KCNH2KMT2A | |
| SCHEMBL4751233 | 0.80 | SIGMAR1 (0.43) | ERCC1ERCC4DRD3KCNH2KMT2A | |
| SCHEMBL4751231 | 0.80 | SIGMAR1 (0.43) | ERCC1ERCC4DRD3KCNH2KMT2A | |
| SCHEMBL3471790 | 0.80 | TP53 (0.56) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL4748954 | 0.79 | SIGMAR1 (0.45) | KMT2AMEN1ALDH1A1 | |
| SCHEMBL4788151 | 0.79 | SIGMAR1 (0.45) | KMT2AMEN1ALDH1A1 |
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-2008136754-A1 | NOVEL BENZYL - 2 -OXO-PIPERAZINYL/ 7-OXO/5-OXA- [1,4] DIAZEPANYL/ 2 -OXO- TETRAHYDROPYRIMIDINYL DERIVATIVES | ASTRAZENECA AB (SE) | 2008-11-13 | — | — | WO | disclosed |
| WO-2008136754-A1 | NOVEL BENZYL - 2 -OXO-PIPERAZINYL/ 7-OXO/5-OXA- [1,4] DIAZEPANYL/ 2 -OXO- TETRAHYDROPYRIMIDINYL DERIVATIVES | ASTRAZENECA AB (SE) | 2008-11-13 | — | — | WO | disclosed |