Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.41 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL19380274 | 0.84 | HDAC4 (0.44) | MAPTTSHRL3MBTL1HTTHDAC3 | |
| SCHEMBL9958705 | 0.82 | HDAC4 (0.62) | MAPTTSHRL3MBTL1HTTHDAC3 | |
| SCHEMBL10153606 | 0.81 | KCNA5 (0.48) | MAPTL3MBTL1HDAC3HDAC4HDAC7 | |
| SCHEMBL31653994 | 0.81 | KCNA5 (0.48) | MAPTL3MBTL1HDAC3HDAC4HDAC7 | |
| SCHEMBL10153609 | 0.79 | MEN1 (0.47) | L3MBTL1HDAC3HDAC4HDAC7HDAC8 | |
| SCHEMBL31653962 | 0.79 | MEN1 (0.47) | L3MBTL1HDAC3HDAC4HDAC7HDAC8 | |
| SCHEMBL10153604 | 0.78 | KCNA5 (0.47) | MAPTHDAC3HDAC4HDAC7HDAC8 | |
| SCHEMBL10153699 | 0.78 | TSHR (0.57) | MAPTTSHRL3MBTL1HTTTHRB | |
| SCHEMBL19380301 | 0.78 | HDAC3 (0.40) | MAPTHSD17B10TSHRHDAC3HDAC4 | |
| SCHEMBL31653964 | 0.77 | TSHR (0.59) | MAPTTSHRL3MBTL1HTTTHRB |
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 |