Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIT | P10721 | 3/20 | 0.44 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.44 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.44 |
| ▸ | BRAF | P15056 | 7/20 | 0.43 |
| ▸ | NQO2 | P16083 | 1/20 | 0.38 |
| ▸ | GABRP | O00591 | 1/20 | 0.36 |
| ▸ | GABRD | O14764 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.36 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.36 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.36 |
| ▸ | UBE2N | P61088 | 1/20 | 0.36 |
| ▸ | GABRE | P78334 | 1/20 | 0.36 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.36 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Dimethylamine SCHEMBL8548190 | 0.92 | KIT (0.46) | KITPDGFRAFGFR3BRAFNQO2 | |
| Dimethylamine SCHEMBL8545876 | 0.88 | KIT (0.55) | KITBRAFNQO2KDM4E | |
| SCHEMBL8547397 | 0.87 | KIT (0.44) | KITPDGFRAFGFR3BRAFKDM4E | |
| SCHEMBL8550032 | 0.86 | BRAF (0.49) | KITPDGFRAFGFR3BRAFKDM4E | |
| SCHEMBL24276997 | 0.85 | KIT (0.57) | KITBRAFNQO2KDM4E | |
| SCHEMBL8543769 | 0.84 | CYP1A2 (0.45) | KITPDGFRAFGFR3KDM4E | |
| SCHEMBL8550027 | 0.82 | KIT (0.42) | KITPDGFRAFGFR3BRAFNQO2 | |
| Dimethylamine SCHEMBL8547837 | 0.80 | KIT (0.54) | KITNQO2GABRA1GABRG2GABRB3 | |
| SCHEMBL8548184 | 0.78 | KIT (0.44) | KITPDGFRAFGFR3BRAFNQO2 | |
| SCHEMBL24277030 | 0.78 | KIT (0.42) | KITPDGFRAFGFR3BRAFNQO2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0591058-B1 | Ellipticine derivatives with antitumor activity | ADIR (FR) | 1998-06-03 | — | — | EP | disclosed |
| US-5498611-A | ANTITUMOR AGENTS | ADIR ET COMPAGNIE (FR) | 1996-03-12 | — | — | US | disclosed |
| US-5407940-A | Antitumor agents | ADIR ET COMPAGNIE (FR) | 1995-04-18 | — | — | US | disclosed |