Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | PARK7 | Q99497 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL10153305 | 0.87 | MEN1 (0.46) | KMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL9959247 | 0.87 | ALDH1A1 (0.42) | KMT2AMEN1ATMPARK7MAPT | |
| SCHEMBL10153698 | 0.87 | ALDH1A1 (0.39) | KMT2AMEN1MAPTALDH1A1LMNA | |
| SCHEMBL9958850 | 0.87 | MEN1 (0.43) | KMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL9959325 | 0.85 | APP (0.42) | KMT2AMEN1MAPTALDH1A1LMNA | |
| SCHEMBL10153594 | 0.85 | ACHE (0.45) | KMT2AMEN1MAPTALDH1A1LMNA | |
| SCHEMBL10153706 | 0.84 | PRMT5 (0.43) | KMT2AMEN1MAPTALDH1A1LMNA | |
| SCHEMBL10153293 | 0.83 | ACHE (0.45) | KMT2AMEN1MAPT | |
| SCHEMBL9959735 | 0.82 | KMT2A (0.33) | KMT2AMEN1CHRM3MAPTALDH1A1 | |
| SCHEMBL10153644 | 0.81 | ALDH1A1 (0.42) | MAPTALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012085003-A1 | 2-HYDROXYISOQUINOLINE-1,3(2H,4H)-DIONES AND RELATED COMPOUNDS USEFUL AS HIV REPLICATION INHIBITORS | KATHOLIEKE UNIVERSITEIT LEUVEN, K.U. LEUVEN R&D (BE) | 2012-06-28 | — | — | WO | disclosed |
| WO-2012085003-A1 | 2-HYDROXYISOQUINOLINE-1,3(2H,4H)-DIONES AND RELATED COMPOUNDS USEFUL AS HIV REPLICATION INHIBITORS | KATHOLIEKE UNIVERSITEIT LEUVEN, K.U. LEUVEN R&D (BE) | 2012-06-28 | — | — | WO | disclosed |