Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 4/20 | 0.44 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.41 |
| ▸ | TNKS | O95271 | 1/20 | 0.41 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.41 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.41 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.41 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.37 |
| ▸ | F10 | P00742 | 1/20 | 0.37 |
| ▸ | FURIN | P09958 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL563746 | 0.80 | PARP10 (0.58) | GSK3BPARP10TNKSPARP15PARP14 | |
| SCHEMBL8488415 | 0.76 | PARP10 (0.58) | GSK3BPARP10AKR1C3SRD5A2 | |
| SCHEMBL13091438 | 0.74 | PARP10 (0.51) | GSK3BPARP10TNKSPARP15PARP14 | |
| SCHEMBL11078518 | 0.71 | MAPK14 (0.52) | PARP10TNKSPARP15PARP14TNKS2 | |
| SCHEMBL11069694 | 0.69 | MAPK14 (0.52) | PARP10TNKSPARP15PARP14TNKS2 | |
| SCHEMBL8922344 | 0.67 | SRD5A2 (0.53) | PARP10TNKSPARP15PARP14TNKS2 | |
| SCHEMBL11071628 | 0.67 | MAPK14 (0.47) | NPSR1MAPTMAPK14CHEK2 | |
| SCHEMBL25172243 | 0.66 | ESRRA (0.60) | PARP10TNKSPARP15PARP14TNKS2 | |
| SCHEMBL693792 | 0.66 | NR4A2 (0.62) | NPC1POLBCYP2C9RAB9AMAPK14 | |
| SCHEMBL11071994 | 0.65 | MAOB (0.63) | CYP2C9RAB9AMAPTHPGDRECQL |
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 |
|---|---|---|---|---|---|---|---|
| EP-2421855-A1 | DIARYL ETHERS | Tibotec Pharmaceuticals (IE) | 2012-02-29 | — | — | EP | disclosed |
| WO-2010122162-A1 | DIARYL ETHERS | TIBOTEC PHARMACEUTICALS (IE) | 2010-10-28 | — | — | WO | disclosed |