Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 5/20 | 0.44 |
| ▸ | FAAH | O00519 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | PTPRC | P08575 | 1/20 | 0.35 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.35 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.35 |
| ▸ | WNK1 | Q9H4A3 | 1/20 | 0.34 |
| ▸ | COMT | P21964 | 2/20 | 0.33 |
| ▸ | PRKDC | P78527 | 1/20 | 0.33 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.33 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6344199 | 0.83 | TLR9 (0.40) | MGLLFAAHALDH1A1TLR9MEN1 | |
| SCHEMBL6345530 | 0.77 | MGLL (0.50) | MGLLFAAHALDH1A1HSP90AA1PKM | |
| SCHEMBL3785977 | 0.73 | ALOX5 (0.40) | ALOX5PTPRCGLO1WNK1PRKDC | |
| SCHEMBL4849912 | 0.73 | HSP90AA1 (0.58) | MGLLFAAHALDH1A1HSP90AA1TLR9 | |
| SCHEMBL4845035 | 0.70 | PRKCB (0.45) | MGLLALDH1A1HTTCYP2E1CYP2A6 | |
| SCHEMBL6355781 | 0.69 | HSP90AA1 (0.46) | MGLLHSP90AA1PKMTLR9 | |
| SCHEMBL6348067 | 0.68 | TLR9 (0.40) | MGLLFAAHALDH1A1TLR9 | |
| SCHEMBL6345973 | 0.68 | MGLL (0.45) | MGLLALDH1A1HSP90AA1HTTCYP2A6 | |
| SCHEMBL17502096 | 0.66 | MPI (0.60) | ALDH1A1HSP90AA1PKMNPC1RAB9A | |
| SCHEMBL3179484 | 0.64 | MGLL (0.88) | MGLLFAAHALDH1A1HSP90AA1PKM |
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-6849643-B2 | Indazolyl-substituted pyrroline compounds as kinase inhibitors | ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) | 2005-02-01 | — | — | US | disclosed |