Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 20/20 | 0.88 |
| ▸ | TNKS | O95271 | 1/20 | 0.74 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.74 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.74 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.74 |
| ▸ | PARP6 | Q2NL67 | 1/20 | 0.74 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.74 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.74 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.74 |
| ▸ | TIPARP | Q7Z3E1 | 1/20 | 0.74 |
| ▸ | PARP8 | Q8N3A8 | 1/20 | 0.74 |
| ▸ | PARP16 | Q8N5Y8 | 1/20 | 0.74 |
| ▸ | PARP12 | Q9H0J9 | 1/20 | 0.74 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.74 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.74 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.74 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.74 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.74 |
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 | |
|---|---|---|---|---|
| SCHEMBL19569971 | 0.92 | PARP1 (0.90) | PARP1TNKSADORA1CDK6PDE3A | |
| SCHEMBL19371189 | 0.92 | PARP1 (0.81) | PARP1TNKSADORA1CDK6PDE3A | |
| SCHEMBL15397405 | 0.91 | PARP1 (0.84) | PARP1TNKSADORA1CDK6PDE3A | |
| SCHEMBL15397404 | 0.91 | PARP1 (0.84) | PARP1TNKSADORA1CDK6PDE3A | |
| SCHEMBL19769966 | 0.91 | PARP1 (1.00) | PARP1TNKSADORA1CDK6PDE3A | |
| SCHEMBL19367087 | 0.90 | PARP1 (0.78) | PARP1TNKSADORA1CDK6PDE3A | |
| SCHEMBL20386905 | 0.90 | PARP1 (0.78) | PARP1TNKSADORA1CDK6PDE3A | |
| SCHEMBL9887628 | 0.90 | PARP1 (0.77) | PARP1TNKSADORA1CDK6PDE3A | |
| SCHEMBL29722673 | 0.90 | PARP1 (0.77) | PARP1TNKSADORA1CDK6PDE3A | |
| SCHEMBL23113149 | 0.90 | PARP1 (0.83) | PARP1TNKSADORA1CDK6PDE3A |
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 |
|---|---|---|---|---|---|---|---|
| US-9649394-B2 | Compositions and methods for in vivo imaging | THE GENERAL HOSPITAL CORPORATION (US) | 2017-05-16 | — | — | US | disclosed |
| US-9649394-B2 | Compositions and methods for in vivo imaging | THE GENERAL HOSPITAL CORPORATION (US) | 2017-05-16 | — | — | US | disclosed |