Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.37 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 5/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.36 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.36 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL669790 | 0.79 | CES2 (0.41) | KDM4ECES2CES1LMNANAPRT | |
| SCHEMBL17858355 | 0.78 | KMT2A (0.51) | KDM4ECES2CES1LMNANAPRT | |
| SCHEMBL1365894 | 0.77 | KDM4E (0.63) | KDM4ECES2CES1LMNANAPRT | |
| SCHEMBL20658449 | 0.76 | RAB9A (0.55) | KDM4ECES2CES1LMNANAPRT | |
| SCHEMBL17842486 | 0.76 | RAB9A (0.55) | KDM4ECES2CES1LMNANAPRT | |
| SCHEMBL17842488 | 0.76 | RAB9A (0.55) | KDM4ECES2CES1LMNANAPRT | |
| SCHEMBL25912775 | 0.75 | CES2 (0.38) | KDM4ECES2CES1LMNANAPRT | |
| SCHEMBL23366565 | 0.72 | KDM4E (0.49) | KDM4ECES2CES1LMNANAPRT | |
| SCHEMBL17842443 | 0.72 | CTNNB1 (0.57) | KDM4ECES2CES1LMNANAPRT | |
| SCHEMBL17842444 | 0.72 | CTNNB1 (0.57) | KDM4ECES2CES1LMNANAPRT |
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-2016100823-A1 | DOPAMINE D2 RECEPTOR LIGANDS | THE BROAD INSTITUTE, INC. (US) | 2016-06-23 | — | — | WO | disclosed |