Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNKS | O95271 | 2/20 | 0.44 |
| ▸ | WNT3A | P56704 | 1/20 | 0.44 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 2/20 | 0.43 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.43 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | KIF11 | P52732 | 3/20 | 0.42 |
| ▸ | PADI4 | Q9UM07 | 2/20 | 0.42 |
| ▸ | CDK4 | P11802 | 1/20 | 0.40 |
| ▸ | CCND1 | P24385 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28738728 | 0.94 | SERPINE1 (0.46) | TNKSWNT3ATNKS2PARP1PARP2 | |
| SCHEMBL29639251 | 0.94 | SERPINE1 (0.46) | TNKSWNT3ATNKS2PARP1PARP2 | |
| SCHEMBL30472340 | 0.87 | TNKS (0.55) | TNKSWNT3ATNKS2PARP1PARP2 | |
| SCHEMBL29031843 | 0.87 | TNKS (0.55) | TNKSWNT3ATNKS2PARP1PARP2 | |
| SCHEMBL31047673 | 0.82 | SERPINE1 (0.45) | TNKSWNT3ATNKS2PARP1PARP2 | |
| SCHEMBL2289172 | 0.81 | KIF11 (0.61) | ESR1ESR2KIF11PADI4KDM4E | |
| SCHEMBL29031875 | 0.80 | ESR1 (0.49) | TNKS2SERPINE1ESR1ESR2KDM4E | |
| SCHEMBL30472324 | 0.80 | ESR1 (0.49) | TNKS2SERPINE1ESR1ESR2KDM4E | |
| SCHEMBL29031862 | 0.80 | SERPINE1 (0.46) | TNKSTNKS2PARP1SERPINE1ESR1 | |
| SCHEMBL29639174 | 0.78 | SERPINE1 (0.67) | TNKSTNKS2PARP1SERPINE1ESR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113666925-B | Method for synthesizing isoindolo [2,1-b ] isoquinoline-5 (7H) -ketone compound | 广州大学 | 2022-05-17 | — | — | CN | disclosed |