Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 1/20 | 0.54 |
| ▸ | GSK3B | P49841 | 1/20 | 0.50 |
| ▸ | FLT1 | P17948 | 1/20 | 0.46 |
| ▸ | FLT4 | P35916 | 1/20 | 0.46 |
| ▸ | KDR | P35968 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL27439105 | 0.86 | ABL1 (0.51) | ABL1FLT1FLT4KDRALDH1A1 | |
| SCHEMBL4043568 | 0.83 | ALDH1A1 (0.67) | ABL1GSK3BFLT1FLT4KDR | |
| SCHEMBL9041985 | 0.81 | ABL1 (0.59) | ABL1FLT1FLT4KDRALDH1A1 | |
| SCHEMBL30249612 | 0.81 | ABL1 (0.59) | ABL1FLT1FLT4KDRALDH1A1 | |
| Hydrochloric Acid SCHEMBL4046791 | 0.81 | ALDH1A1 (0.65) | ABL1GSK3BFLT1FLT4KDR | |
| SCHEMBL29859075 | 0.81 | ALDH1A1 (0.69) | GSK3BALDH1A1MAPK1HIF1AKDM4E | |
| SCHEMBL641759 | 0.81 | ALDH1A1 (0.69) | GSK3BALDH1A1MAPK1HIF1AKDM4E | |
| SCHEMBL7779200 | 0.79 | GSK3B (0.52) | GSK3BFLT1FLT4KDRALDH1A1 | |
| SCHEMBL10159191 | 0.79 | GSK3B (0.52) | GSK3BALDH1A1MAPK1HIF1AKDM4E | |
| SCHEMBL30702134 | 0.79 | GSK3B (0.52) | GSK3BFLT1FLT4KDRALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0760819-B1 | TRICYCLIC DICARBONYL DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2000-07-19 | — | — | EP | disclosed |
| US-5688803-A | BRAIN DISORDERS; PSYCHOLOGICAL DISORDERS | HOFFMANN-LA ROCHE INC. (US) | 1997-11-18 | — | — | US | disclosed |
| EP-0760819-A1 | TRICYCLIC DICARBONYL DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 1997-03-12 | — | — | EP | disclosed |
| WO-1995032205-A1 | TRICYCLIC DICARBONYL DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 1995-11-30 | — | — | WO | disclosed |