Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKB | Q96GD4 | 10/20 | 0.54 |
| ▸ | INCENP | Q9NQS7 | 10/20 | 0.54 |
| ▸ | TTK | P33981 | 9/20 | 0.54 |
| ▸ | AURKA | O14965 | 8/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | THRB | P10828 | 2/20 | 0.50 |
| ▸ | CASP1 | P29466 | 2/20 | 0.50 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.50 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL10998739 | 0.84 | TTK (0.57) | AURKBINCENPTTKAURKAMAPT | |
| SCHEMBL11000281 | 0.82 | TTK (0.54) | AURKBINCENPTTKAURKAMAPT | |
| SCHEMBL10996933 | 0.81 | TTK (0.55) | AURKBINCENPTTKAURKAMAPT | |
| SCHEMBL11003225 | 0.81 | TTK (0.50) | AURKBINCENPTTKAURKAMAPT | |
| SCHEMBL11002890 | 0.80 | CYP11B1 (0.36) | AURKBINCENPTTKAURKACYP11B1 | |
| SCHEMBL11448065 | 0.80 | AURKB (0.50) | AURKBINCENPTTKAURKAMAPT | |
| SCHEMBL11000547 | 0.78 | CYP11B2 (0.56) | PDE3BPDE3AKDM4EALDH1A1LMNA | |
| SCHEMBL10995582 | 0.78 | AURKB (0.51) | AURKBINCENPTTKAURKAMAPT | |
| SCHEMBL11458612 | 0.76 | AURKB (0.57) | AURKBINCENPTTKAURKAMAPT | |
| SCHEMBL11001428 | 0.75 | TTK (0.59) | AURKBINCENPTTKAURKAMAPT |
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-4514400-A | Cardiotonic 5-heteroaryl-pyridone | WILLIAM H. RORER, INC. (US) | 1985-04-30 | — | — | US | disclosed |