Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GNRHR | P30968 | 6/20 | 0.44 |
| ▸ | SYK | P43405 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 2/20 | 0.42 |
| ▸ | DRD3 | P35462 | 2/20 | 0.42 |
| ▸ | DHODH | Q02127 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | ALDH1A2 | O94788 | 1/20 | 0.39 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL5250582 | 0.92 | DRD2 (0.45) | GNRHRDRD2DRD3DHODHHRH3 | |
| SCHEMBL5251170 | 0.91 | DRD2 (0.47) | GNRHRDRD2DRD3HRH3KDM4E | |
| SCHEMBL5256363 | 0.89 | CHEK1 (0.47) | DRD2DRD3DHODHHRH3ALDH1A1 | |
| SCHEMBL5329494 | 0.88 | DRD4 (0.43) | GNRHRDRD2DRD3DHODHALDH1A1 | |
| SCHEMBL5253308 | 0.88 | HRH3 (0.45) | GNRHRDRD2DRD3HRH3HTR2A | |
| SCHEMBL5255275 | 0.86 | TLR9 (0.46) | DHODHHRH3ALDH1A1ALDH1A2ALDH1A3 | |
| SCHEMBL5248611 | 0.85 | CHEK1 (0.44) | SYKDRD2DRD3DHODHHRH3 | |
| SCHEMBL5248183 | 0.85 | TLR9 (0.42) | DHODHALDH1A1ALDH1A2ALDH1A3KDM4E | |
| SCHEMBL5076308 | 0.85 | DHODH (0.50) | GNRHRSYKDHODHHRH3ALDH1A1 | |
| SCHEMBL5300289 | 0.85 | DGAT1 (0.42) | GNRHRDRD2DRD3DHODHALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1257551-B1 | HETEROCYCLIC COMPOUNDS AND THEIR USE AS PARP INHIBITORS | ABBOTT GMBH & CO KG (DE) | 2007-09-05 | — | — | EP | disclosed |