Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 3/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.33 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.33 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.32 |
| ▸ | IP6K3 | Q96PC2 | 1/20 | 0.32 |
| ▸ | IP6K2 | Q9UHH9 | 1/20 | 0.32 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.32 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 2/20 | 0.31 |
| ▸ | MAOB | P27338 | 2/20 | 0.31 |
| ▸ | PLK1 | P53350 | 1/20 | 0.31 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.31 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | BACE1 | P56817 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6090485 | 1.00 | DAO (0.35) | DAOPKMKDRALDH1A1ALDH2 | |
| SCHEMBL6090145 | 0.88 | PDPK1 (0.34) | PKMKDRGPR84MAP4K1 | |
| SCHEMBL6091001 | 0.88 | GFER (0.32) | MAP4K1 | |
| SCHEMBL6090999 | 0.88 | GFER (0.32) | MAP4K1 | |
| SCHEMBL6089383 | 0.86 | TUBB4A (0.37) | DAOPKMKDRIP6K1IP6K3 | |
| SCHEMBL6089379 | 0.86 | TUBB4A (0.37) | DAOPKMKDRIP6K1IP6K3 | |
| SCHEMBL6091447 | 0.80 | PDPK1 (0.47) | KDRALDH1A1NTRK1 | |
| SCHEMBL6090324 | 0.78 | MAPT (0.38) | KDRALDH1A1PTPN1 | |
| SCHEMBL6090321 | 0.78 | MAPT (0.38) | KDRALDH1A1PTPN1 | |
| SCHEMBL6089196 | 0.76 | SIRT1 (0.46) | KDRMAOB |
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-7060822-B1 | 2-pyrazolin-5-ones | ABBOTT GMBH & CO. KG (DE) | 2006-06-13 | — | — | US | disclosed |