Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 8/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.37 |
| ▸ | APAF1 | O14727 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | ELANE | P08246 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19090330 | 0.88 | ALDH1A1 (0.48) | HTTLMNAALDH1A1POLBTSHR | |
| SCHEMBL19090309 | 0.86 | LMNA (0.40) | HTTLMNAALDH1A1POLBTSHR | |
| SCHEMBL19090470 | 0.82 | TSHR (0.44) | HTTLMNAALDH1A1POLBTSHR | |
| SCHEMBL19090318 | 0.81 | ELANE (0.41) | ALDH1A1POLBTSHRL3MBTL1KDM4E | |
| SCHEMBL19090329 | 0.78 | BRD4 (0.46) | HTTLMNAALDH1A1POLBTSHR | |
| SCHEMBL21389556 | 0.72 | BRD4 (0.54) | HTTLMNAALDH1A1POLBTSHR | |
| SCHEMBL19090328 | 0.68 | MAPT (0.48) | HTTLMNAALDH1A1POLBTSHR | |
| SCHEMBL19090209 | 0.66 | APOBEC3G (0.47) | HTTLMNAALDH1A1POLBKDM4E | |
| SCHEMBL19090593 | 0.66 | BRD4 (0.34) | — | |
| SCHEMBL24198810 | 0.65 | LMNA (0.44) | HTTLMNAALDH1A1POLBTSHR |
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-2017114843-A1 | XANTHINE DERIVATIVE INHIBITORS OF BET PROTEINS | INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) | 2017-07-06 | — | — | WO | disclosed |