Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNKS | O95271 | 3/20 | 0.51 |
| ▸ | TNKS2 | Q9H2K2 | 3/20 | 0.51 |
| ▸ | GPR3 | P46089 | 1/20 | 0.46 |
| ▸ | PARP1 | P09874 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL20427271 | 0.76 | MAPT (0.47) | TNKSTNKS2GPR3ALDH1A1KDM4E | |
| SCHEMBL793946 | 0.74 | MAPT (0.47) | TNKSTNKS2GPR3PARP1ALDH1A1 | |
| SCHEMBL21243890 | 0.73 | PARP1 (0.40) | TNKSTNKS2PARP1ALDH1A1KDM4E | |
| SCHEMBL15497424 | 0.73 | GPR3 (0.68) | TNKSTNKS2GPR3ALDH1A1KDM4E | |
| SCHEMBL1039859 | 0.73 | GPR3 (0.68) | TNKSTNKS2GPR3ALDH1A1KDM4E | |
| SCHEMBL23842973 | 0.72 | GPR3 (0.54) | TNKSTNKS2GPR3PARP1ALDH1A1 | |
| SCHEMBL15684376 | 0.71 | MAPT (0.46) | TNKSTNKS2GPR3PARP1ALDH1A1 | |
| SCHEMBL4074785 | 0.70 | MEN1 (0.62) | TNKSTNKS2GPR3PARP1ALDH1A1 | |
| SCHEMBL18647351 | 0.70 | MEN1 (0.53) | TNKSTNKS2GPR3PARP1ALDH1A1 | |
| SCHEMBL4208864 | 0.70 | KRAS (0.51) | TNKSTNKS2PARP1KDM4ERAB9A |
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-2627648-A1 | 17aHYDROXYLASE/C17,20-LYASE INHIBITORS | Novartis AG (CH) | 2013-08-21 | — | — | EP | disclosed |
| WO-2012035078-A1 | 17α-HYDROXYLASE/C17,20-LYASE INHIBITORS | NOVARTIS AG (CH) | 2012-03-22 | — | — | WO | disclosed |