Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | MMP13 | P45452 | 4/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | AXL | P30530 | 1/20 | 0.38 |
| ▸ | MMP7 | P09237 | 1/20 | 0.37 |
| ▸ | MMP10 | P09238 | 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 | |
|---|---|---|---|---|
| SCHEMBL10153706 | 0.89 | PRMT5 (0.43) | ALDH1A1RAB9ALMNAKMT2AMEN1 | |
| SCHEMBL9952468 | 0.87 | ALDH1A1 (0.50) | ALDH1A1RAB9AMMP13DRD2KDM4E | |
| SCHEMBL10153721 | 0.86 | KDR (0.47) | LMNAL3MBTL1 | |
| SCHEMBL9958824 | 0.85 | ALDH1A1 (0.44) | ALDH1A1RAB9ALMNAKMT2AMEN1 | |
| SCHEMBL9959556 | 0.84 | PRMT5 (0.46) | ALDH1A1KMT2AGAAMEN1L3MBTL1 | |
| SCHEMBL9959528 | 0.80 | L3MBTL1 (0.37) | ALDH1A1RAB9AKDM4ELMNAKMT2A | |
| SCHEMBL9959313 | 0.79 | KCNA5 (0.48) | ALDH1A1HPGDLMNAKMT2AMEN1 | |
| SCHEMBL10153600 | 0.76 | MAPT (0.44) | ALDH1A1RAB9AKDM4ELMNAKMT2A | |
| SCHEMBL9959300 | 0.76 | ALDH1A1 (0.42) | ALDH1A1RAB9AKDM4EHPGDKMT2A | |
| SCHEMBL9959558 | 0.76 | KCNA5 (0.46) | ALDH1A1LMNAKMT2AMEN1SMN1; 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 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 |