Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL9959015 | 0.82 | MEN1 (0.49) | KDM4ETSHRKMT2AALDH1A1MEN1 | |
| SCHEMBL9959279 | 0.80 | KDM4E (0.44) | KDM4ETSHRKMT2AALDH1A1MEN1 | |
| SCHEMBL10154016 | 0.77 | MEN1 (0.38) | KDM4EKMT2AALDH1A1MEN1L3MBTL1 | |
| SCHEMBL10153314 | 0.77 | KMT2A (0.54) | KDM4ETSHRKMT2AALDH1A1MEN1 | |
| SCHEMBL10153707 | 0.76 | KMT2A (0.55) | KDM4EKMT2AALDH1A1MEN1GAA | |
| SCHEMBL19380275 | 0.75 | ALDH1A1 (0.42) | KMT2AALDH1A1MEN1CYP1A2HPGD | |
| SCHEMBL31653849 | 0.75 | ALDH1A1 (0.42) | KMT2AALDH1A1MEN1CYP1A2HPGD | |
| SCHEMBL9952553 | 0.75 | KMT2A (0.54) | KDM4EKMT2AALDH1A1MEN1GAA | |
| SCHEMBL9952669 | 0.75 | KMT2A (0.54) | KDM4EKMT2AALDH1A1MEN1GAA | |
| SCHEMBL9959705 | 0.75 | KMT2A (0.54) | KDM4EKMT2AALDH1A1MEN1GAA |
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 |