Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.47 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | CTNNB1 | P35222 | 3/20 | 0.42 |
| ▸ | WNT3A | P56704 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | HSD17B14 | Q9BPX1 | 1/20 | 0.41 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.41 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.40 |
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 | 0.81 | CES2 (0.41) | KMT2ACES2CES1LMNAL3MBTL1 | |
| SCHEMBL38132 | 0.80 | ALDH1A1 (0.44) | KMT2ACES2CES1LMNANAPRT | |
| SCHEMBL25912775 | 0.78 | CES2 (0.38) | KMT2ACES2CES1LMNAL3MBTL1 | |
| SCHEMBL17858353 | 0.78 | KDM4E (0.45) | KMT2ACES2CES1LMNAL3MBTL1 | |
| SCHEMBL23748145 | 0.76 | KMT2A (0.47) | KMT2ACES2CES1LMNAL3MBTL1 | |
| SCHEMBL31369148 | 0.75 | KMT2A (0.75) | KMT2ACES2CES1LMNAL3MBTL1 | |
| SCHEMBL87791 | 0.75 | KMT2A (0.75) | KMT2ACES2CES1LMNAL3MBTL1 | |
| SCHEMBL5717594 | 0.75 | L3MBTL1 (0.64) | KMT2ACES2CES1LMNAL3MBTL1 | |
| SCHEMBL30118935 | 0.75 | KMT2A (0.58) | KMT2ACES2CES1LMNAL3MBTL1 | |
| SCHEMBL8710005 | 0.75 | KMT2A (0.58) | KMT2ACES2CES1LMNAL3MBTL1 |
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 |