Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | GPR3 | P46089 | 1/20 | 0.41 |
| ▸ | STAT3 | P40763 | 1/20 | 0.35 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.35 |
| ▸ | HTR3B | O95264 | 1/20 | 0.35 |
| ▸ | HTR3A | P46098 | 1/20 | 0.35 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.35 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.35 |
| ▸ | NQO1 | P15559 | 1/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.34 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
| ▸ | NOS2 | P35228 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 5/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.34 |
| ▸ | LCK | P06239 | 1/20 | 0.34 |
| ▸ | FYN | P06241 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7900647 | 0.97 | KDM4E (0.41) | KIF11KDM4EGPR3STAT3HTR3E | |
| SCHEMBL11743927 | 0.92 | KIF11 (0.43) | KIF11KDM4EGPR3STAT3HTR3E | |
| SCHEMBL17409892 | 0.91 | KIF11 (0.42) | KIF11KDM4EGPR3STAT3HTR3E | |
| SCHEMBL7893959 | 0.90 | KDM4E (0.43) | KIF11KDM4EGPR3ACHEALDH1A1 | |
| Phenanthridine SCHEMBL27966445 | 0.82 | KDM4E (0.56) | KIF11KDM4EGPR3HTR3EHTR3B | |
| SCHEMBL27565446 | 0.82 | HPRT1 (0.52) | KIF11NQO1ACHEALDH1A1CYP1A2 | |
| SCHEMBL2089665 | 0.80 | HPRT1 (0.54) | KIF11NQO1ACHEALDH1A1CYP1A2 | |
| Chrysene SCHEMBL27616409 | 0.80 | HPRT1 (0.54) | KIF11NQO1ACHEALDH1A1CYP1A2 | |
| SCHEMBL21176632 | 0.80 | HPRT1 (0.54) | KIF11NQO1ACHEALDH1A1CYP1A2 | |
| SCHEMBL30928215 | 0.80 | HPRT1 (0.54) | KIF11NQO1ACHEALDH1A1CYP1A2 |
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-6187783-B1 | ANTITUMOR AGENTS | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 2001-02-13 | — | — | US | disclosed |