Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 4/20 | 0.39 |
| ▸ | PARP2 | Q9UGN5 | 4/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | UGCG | Q16739 | 4/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 2/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | XIAP | P98170 | 1/20 | 0.33 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20468587 | 0.79 | PARP1 (0.58) | PARP1PARP2NPC1UGCGHTT | |
| SCHEMBL12714907 | 0.79 | PARP1 (0.40) | PARP1PARP2UGCGMAPTNR1I2 | |
| SCHEMBL29955619 | 0.79 | PARP1 (0.58) | PARP1PARP2NPC1UGCGHTT | |
| SCHEMBL18086767 | 0.79 | PARP1 (0.38) | PARP1PARP2UGCGKCNH2THRB | |
| SCHEMBL24469715 | 0.78 | UGCG (0.59) | PARP1PARP2UGCGNR1I2 | |
| SCHEMBL24469605 | 0.78 | UGCG (0.59) | PARP1PARP2UGCGNR1I2 | |
| SCHEMBL12714309 | 0.78 | CRBN (0.44) | PARP1PARP2POLBUGCGTHRB | |
| SCHEMBL17517178 | 0.78 | MEN1 (0.37) | PARP1PARP2UGCGKCNH2NR1I2 | |
| SCHEMBL18086769 | 0.78 | P2RX7 (0.41) | PARP1PARP2KCNH2P2RX7 | |
| SCHEMBL17517172 | 0.77 | HTR2C (0.44) | PARP1PARP2UGCGKCNH2NR1I2 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |