Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 9/20 | 0.51 |
| ▸ | TNKS | O95271 | 3/20 | 0.51 |
| ▸ | TNKS2 | Q9H2K2 | 3/20 | 0.51 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | BRD2 | P25440 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.37 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 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 | |
|---|---|---|---|---|
| SCHEMBL6785941 | 0.74 | GRIA1 (0.50) | PARP1TNKSTNKS2 | |
| SCHEMBL26031688 | 0.74 | BRPF1 (0.35) | BRD4 | |
| SCHEMBL24968861 | 0.71 | TNKS (0.47) | PARP1TNKSTNKS2BRD4BRD2 | |
| SCHEMBL15775409 | 0.68 | PARP1 (1.00) | PARP1TNKSTNKS2ALDH1A1HPGD | |
| SCHEMBL19957595 | 0.68 | TNKS (0.43) | PARP1TNKSTNKS2BRD4BRD2 | |
| SCHEMBL20312995 | 0.68 | TNKS (0.38) | PARP1TNKSTNKS2BRD4BRD2 | |
| SCHEMBL26017983 | 0.68 | TNKS (0.43) | PARP1TNKSTNKS2ALDH1A1HPGD | |
| SCHEMBL8276444 | 0.67 | NOTUM (0.50) | PARP1TNKSTNKS2ALDH1A1HPGD | |
| SCHEMBL2095934 | 0.67 | ALDH1A1 (0.41) | PARP1TNKSTNKS2BRD4BRD2 | |
| SCHEMBL2733549 | 0.67 | TNKS (0.49) | PARP1TNKSTNKS2ALDH1A1HPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5391554-A | Antitumor agent | WARNER-LAMBERT COMPANY (US) | 1995-02-21 | — | — | US | claimed |
| WO-1994005664-A1 | NAPHTHYRIDINES AS POTENTIATORS OF LETHAL EFFECTS OF RADIATION ON TUMOUR CELLS | WARNER-LAMBERT COMPANY (US) | 1994-03-17 | — | — | WO | claimed |
| WO-1994005664-A1 | NAPHTHYRIDINES AS POTENTIATORS OF LETHAL EFFECTS OF RADIATION ON TUMOUR CELLS | WARNER-LAMBERT COMPANY (US) | 1994-03-17 | — | — | WO | disclosed |