Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | BACE1 | P56817 | 1/20 | 0.47 |
| ▸ | TNF | P01375 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10153976 | 0.91 | TP53 (0.56) | NPC1RAB9AALDH1A1SMN1; SMN2TP53 | |
| SCHEMBL9959313 | 0.88 | KCNA5 (0.48) | ALDH1A1SMN1; SMN2POLBKMT2AMAPT | |
| SCHEMBL9959558 | 0.86 | KCNA5 (0.46) | PKMALDH1A1SMN1; SMN2KMT2AMAPT | |
| SCHEMBL9959177 | 0.85 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2POLBKMT2A | |
| SCHEMBL9958824 | 0.84 | ALDH1A1 (0.44) | RAB9AALDH1A1SMN1; SMN2POLBKMT2A | |
| SCHEMBL9958635 | 0.84 | ALDH1A1 (0.50) | NPC1PKMRAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL10153642 | 0.81 | KCNA5 (0.42) | ALDH1A1SMN1; SMN2TP53KMT2AMAPT | |
| SCHEMBL9951942 | 0.81 | MAPT (0.47) | ALDH1A1SMN1; SMN2POLBKMT2AMAPT | |
| SCHEMBL9959556 | 0.80 | PRMT5 (0.46) | PKMALDH1A1SMN1; SMN2TP53POLB | |
| SCHEMBL9958850 | 0.79 | MEN1 (0.43) | ALDH1A1HSD17B10POLBKMT2AMAPT |
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 |