Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PADI1 | Q9ULC6 | 2/20 | 0.46 |
| ▸ | PADI3 | Q9ULW8 | 2/20 | 0.46 |
| ▸ | PADI4 | Q9UM07 | 2/20 | 0.46 |
| ▸ | PADI2 | Q9Y2J8 | 2/20 | 0.46 |
| ▸ | PDE4A | P27815 | 1/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.43 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.43 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 3/20 | 0.41 |
| ▸ | PTPRC | P08575 | 2/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.38 |
| ▸ | PTPRF | P10586 | 1/20 | 0.38 |
| ▸ | CDC25B | P30305 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21801708 | 0.81 | PADI1 (0.68) | PADI1PADI3PADI4PADI2PDE4A | |
| SCHEMBL21801740 | 0.76 | IDO1 (0.40) | PADI1PADI3PADI4PADI2PDE4A | |
| SCHEMBL21801713 | 0.76 | P4HB (0.40) | PADI1PADI3PADI4PADI2PDE4A | |
| SCHEMBL31460555 | 0.76 | RAB9A (0.48) | PADI1PADI3PADI4PADI2PTPRC | |
| SCHEMBL21801716 | 0.75 | PADI1 (0.40) | PADI1PADI3PADI4PADI2PDE4A | |
| SCHEMBL31337073 | 0.74 | MAOB (0.42) | MAPTRAB9ANPC1SMN1; SMN2PKM | |
| SCHEMBL21801729 | 0.74 | AURKA (0.50) | CDC25BMAPTRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL28987151 | 0.72 | CDC25B (0.47) | PADI1PADI3PADI4PADI2CDC25B | |
| SCHEMBL21801789 | 0.72 | NSD2 (0.65) | PADI1PADI3PADI4PADI2PDE4B | |
| SCHEMBL4049450 | 0.71 | RAB9A (0.54) | PADI4PTPRCMAPTRAB9ANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020055192-A2 | PREPARATION METHOD FOR QUINOLINE-5, 8-DIONE DERIVATIVE WHICH IS TGASE 2 INHIBITOR | 재단법인 대구경북첨단의료산업진흥재단 | 2020-03-19 | — | — | WO | disclosed |