Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 3/20 | 0.38 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 5/20 | 0.35 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.35 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.34 |
| ▸ | CXCR3 | P49682 | 4/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL18409112 | 0.89 | KMT2A (0.40) | SMN1; SMN2KDM4ENPSR1L3MBTL1HTT | |
| SCHEMBL18409259 | 0.81 | MEN1 (0.40) | SMN1; SMN2KDM4EMEN1GAAKMT2A | |
| SCHEMBL18409277 | 0.81 | JAK2 (0.37) | S1PR1S1PR5NR1H4 | |
| SCHEMBL18409179 | 0.79 | SLC6A2 (0.36) | KDM4EMEN1GAAKMT2ALMNA | |
| SCHEMBL18409115 | 0.78 | POLB (0.40) | SMN1; SMN2KDM4EHTTMEN1GAA | |
| SCHEMBL18409326 | 0.75 | JAK2 (0.41) | SMN1; SMN2KDM4EMEN1GAAKMT2A | |
| SCHEMBL18409113 | 0.75 | ALDH1A1 (0.36) | KDM4ENPSR1MEN1KMT2AALDH1A1 | |
| SCHEMBL18409110 | 0.74 | POLB (0.33) | KDM4EMEN1KMT2ALMNAPTGDR2 | |
| SCHEMBL18409118 | 0.73 | CCNE2 (0.36) | SMN1; SMN2KDM4ENPSR1L3MBTL1HTT | |
| SCHEMBL18409291 | 0.73 | JAK2 (0.37) | KDM4EMEN1KMT2ANR1H4ALDH1A1 |
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-2017012647-A1 | NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF INFLAMMATORY DISORDERS | GALAPAGOS NV (BE) | 2017-01-26 | — | — | WO | disclosed |