Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 10/20 | 0.47 |
| ▸ | ACACA | Q13085 | 10/20 | 0.47 |
| ▸ | BUB1 | O43683 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.39 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.39 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.39 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.39 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2355632 | 0.89 | ACACB (0.59) | ACACBACACABUB1HTTNTRK2 | |
| SCHEMBL13817830 | 0.81 | HTT (0.42) | ACACBACACABUB1HTTKDM4E | |
| SCHEMBL10193397 | 0.76 | ACACB (0.61) | ACACBACACAMAOAMAOBTYRO3 | |
| SCHEMBL6113719 | 0.71 | ACACB (0.66) | ACACBACACAMAOAMAOBNTRK2 | |
| SCHEMBL13761056 | 0.70 | RARA (0.46) | BUB1KDM4EALDH1A1SMN1; SMN2RARB | |
| SCHEMBL13817785 | 0.70 | ACACB (0.42) | ACACBACACABUB1HTTALDH1A1 | |
| SCHEMBL13817862 | 0.69 | ACACB (0.51) | ACACBACACANTRK2ALDH1A1 | |
| SCHEMBL11941316 | 0.69 | ACACB (0.65) | ACACBACACAPGRNTRK2TDP2 | |
| SCHEMBL12128974 | 0.69 | ACACB (0.39) | ACACBACACAHTTMAOAMAOB | |
| SCHEMBL13817869 | 0.69 | ACACB (0.51) | ACACBACACAHTTNTRK2HPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-7547660-B2 | Phenyl-substituted 4-hydroxy-tetrahydropyridones | BAYER AKTIENGESELLSCHAFT (DE) | 2009-06-16 | — | — | US | disclosed |
| US-7547660-B2 | Phenyl-substituted 4-hydroxy-tetrahydropyridones | BAYER AKTIENGESELLSCHAFT (DE) | 2009-06-16 | — | — | US | disclosed |