Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERCC1 | P07992 | 1/20 | 0.48 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.48 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.45 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL15038459 | 0.88 | ERCC1 (0.54) | ERCC1ERCC4DDB1CRBNDRD3 | |
| SCHEMBL24709610 | 0.77 | ALDH1A1 (0.46) | ERCC1ERCC4DRD3KCNH2MEN1 | |
| Bromide SCHEMBL31141392 | 0.76 | ALDH1A1 (0.45) | ERCC1ERCC4DRD3KCNH2MEN1 | |
| SCHEMBL4749191 | 0.75 | ALDH1A1 (0.71) | ERCC1ERCC4DRD3KCNH2MEN1 | |
| SCHEMBL9164640 | 0.74 | EPHX2 (0.49) | ERCC1ERCC4DDB1CRBNDRD3 | |
| SCHEMBL4786883 | 0.71 | SMN1; SMN2 (0.73) | ERCC1ERCC4DRD3KCNH2MEN1 | |
| SCHEMBL18835681 | 0.70 | ERCC1 (0.59) | ERCC1ERCC4DRD3KCNH2MEN1 | |
| SCHEMBL9514131 | 0.70 | ALDH1A1 (0.60) | ERCC1ERCC4DRD3KCNH2P2RX7 | |
| SCHEMBL4692001 | 0.68 | MEN1 (0.47) | ERCC1ERCC4DRD3KCNH2MEN1 | |
| SCHEMBL15015764 | 0.67 | MEN1 (0.42) | ERCC1ERCC4MEN1KMT2AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2604260-B1 | NOVEL HETEROCYCLIC DERIVATIVES AND PHARMACEUTICAL COMPOSITION CONTAINING SAME | SHIONOGI & CO (JP) | 2017-05-10 | — | — | EP | disclosed |