Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA5 | P22460 | 2/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 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 | |
|---|---|---|---|---|
| SCHEMBL9958882 | 0.94 | KMT2A (0.46) | KCNA5FFAR1KMT2AMEN1MAPT | |
| SCHEMBL10154063 | 0.93 | KMT2A (0.47) | KCNA5KMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL9959019 | 0.92 | KMT2A (0.47) | KCNA5KMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL10153579 | 0.92 | KMT2A (0.47) | KCNA5KMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL9959738 | 0.92 | KMT2A (0.47) | KCNA5KMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL9959313 | 0.88 | KCNA5 (0.48) | KCNA5KMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL9959312 | 0.87 | DRD2 (0.41) | KCNA5KMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL10153971 | 0.85 | POLB (0.50) | KCNA5KMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL9959297 | 0.85 | HDAC4 (0.49) | KCNA5FFAR1KMT2AMEN1MAPT | |
| SCHEMBL10153600 | 0.85 | MAPT (0.44) | KMT2AMEN1MAPTALDH1A1SMN1; SMN2 |
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-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 |