Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 15/20 | 0.53 |
| ▸ | UNG | P13051 | 1/20 | 0.47 |
| ▸ | PARP10 | Q53GL7 | 6/20 | 0.44 |
| ▸ | PARP15 | Q460N3 | 4/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | PARP14 | Q460N5 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TNKS | O95271 | 1/20 | 0.42 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1515569 | 0.85 | PARP1 (0.50) | PARP1UNGPARP10PARP15TSHR | |
| SCHEMBL13699195 | 0.84 | PARP1 (0.49) | PARP1PARP10PARP15TSHRPARP14 | |
| SCHEMBL7521628 | 0.83 | UNG (0.69) | UNGHSD17B10KMT2A | |
| SCHEMBL723945 | 0.82 | UNG (0.68) | PARP1UNGPARP10PARP15TSHR | |
| SCHEMBL29958104 | 0.82 | UNG (0.68) | PARP1UNGPARP10PARP15TSHR | |
| SCHEMBL18890217 | 0.81 | PARP1 (0.57) | PARP1UNGPARP10PARP15TSHR | |
| SCHEMBL20810556 | 0.79 | FAAH (0.46) | PARP1TSHRCYP3A4CYP2C19MEN1 | |
| SCHEMBL7516679 | 0.79 | P4HB (0.55) | TSHRPOLBMAPTTDP1MEN1 | |
| SCHEMBL16950860 | 0.79 | PARP1 (0.55) | PARP1UNGPARP10PARP15TSHR | |
| SCHEMBL7615559 | 0.78 | PARP1 (0.53) | PARP1UNGPARP10PARP15TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007130499-A2 | ANTIVIRAL AGENTS | VIROBAY, INC. (US) | 2007-11-15 | — | — | WO | claimed |