Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 2/20 | 0.39 |
| ▸ | JAK1 | P23458 | 2/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | NOS1 | P29475 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
| ▸ | MITF | O75030 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL16114399 | 0.79 | ALDH1A1 (0.49) | ALDH1A1NPSR1NOTUMKDM4EKMT2A | |
| SCHEMBL5855553 | 0.78 | ALDH1A1 (0.45) | ALDH1A1NPSR1NOTUMKDM4EKMT2A | |
| SCHEMBL18284817 | 0.76 | NOTUM (0.43) | NOTUMNOS3NOS1NOS2AMY1A | |
| SCHEMBL12615992 | 0.76 | ALDH1A1 (0.68) | ALDH1A1NPSR1NOTUMKDM4EKMT2A | |
| SCHEMBL15758070 | 0.76 | KCNJ1 (0.44) | ALDH1A1NPSR1NOTUMKDM4EKMT2A | |
| SCHEMBL30084182 | 0.76 | ALDH1A1 (0.58) | ALDH1A1NPSR1NOTUMKDM4EKMT2A | |
| SCHEMBL5330184 | 0.76 | ALDH1A1 (0.58) | ALDH1A1NPSR1NOTUMKDM4EKMT2A | |
| SCHEMBL17978905 | 0.75 | ALDH1A1 (0.45) | ALDH1A1NPSR1NOTUMKDM4EKMT2A | |
| SCHEMBL5854751 | 0.75 | ALDH1A1 (0.49) | ALDH1A1NPSR1NOTUMKDM4EKMT2A | |
| SCHEMBL11146019 | 0.73 | ALDH1A1 (0.54) | ALDH1A1NPSR1NOTUMKDM4EKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2464228-A1 | SUBSTITUTED CYCLOPROPYL COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT | Merck Sharp & Dohme Corp. (US) | 2012-06-20 | — | — | EP | claimed |