Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.39 |
| ▸ | KDM5A | P29375 | 1/20 | 0.39 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.39 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8149849 | 0.80 | ALDH1A1 (0.42) | TP53ALDH1A1MAPTSMN1; SMN2RIPK1 | |
| SCHEMBL8153723 | 0.76 | TP53 (0.43) | TP53MAPTSMN1; SMN2RIPK1LMNA | |
| SCHEMBL8154303 | 0.76 | FDPS (0.47) | ALDH1A1MAPTSMN1; SMN2HPGDPKM | |
| SCHEMBL8158956 | 0.75 | TP53 (0.42) | TP53ALDH1A1MAPTSMN1; SMN2RIPK1 | |
| SCHEMBL30452008 | 0.75 | GSK3B (0.44) | TP53TLR7ALDH1A1MAPTLMNA | |
| SCHEMBL2188003 | 0.75 | MEN1 (0.54) | ALDH1A1MAPTSMN1; SMN2RIPK1HPGD | |
| SCHEMBL30251861 | 0.73 | KDM4E (0.62) | ALDH1A1KDM4CTSHRHSD17B10KDM4E | |
| SCHEMBL496589 | 0.73 | KDM4E (0.62) | ALDH1A1KDM4CTSHRHSD17B10KDM4E | |
| SCHEMBL7360572 | 0.72 | HTR3A (0.52) | ALDH1A1MAPTHPGDPKMKDM4E | |
| SCHEMBL3652058 | 0.71 | ALDH1A1 (0.64) | ALDH1A1MAPTSMN1; SMN2LMNAHPGD |
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-1019380-A2 | TRICYCLIC 3-OXO-PROPANENITRILE COMPOUNDS | PHARMACIA & UPJOHN S.p.A. (IT) | 2000-07-19 | — | — | EP | disclosed |
| WO-1999016753-A2 | TRICYCLIC 3-OXO-PROPANENITRILE COMPOUNDS | PHARMACIA & UPJOHN S.P.A. (IT) | 1999-04-08 | — | — | WO | disclosed |