Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 9/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | PHGDH | O43175 | 1/20 | 0.34 |
| ▸ | FAAH | O00519 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | CMA1 | P23946 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | TACR3 | P29371 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19575392 | 0.88 | ALDH1A1 (0.39) | SMN1; SMN2ALDH1A1LMNAHTTKDM4E | |
| SCHEMBL26224146 | 0.86 | ALDH1A1 (0.37) | PPARGSMN1; SMN2ALDH1A1LMNAHTT | |
| SCHEMBL26212539 | 0.82 | HDAC1 (0.42) | — | |
| SCHEMBL19575639 | 0.82 | HDAC1 (0.42) | — | |
| SCHEMBL19574920 | 0.80 | ADORA2A (0.49) | SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL26212177 | 0.80 | ADORA2A (0.49) | SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL26212223 | 0.80 | TMIGD3 (0.41) | SMN1; SMN2ALDH1A1LMNAHTTNPC1 | |
| SCHEMBL19575371 | 0.80 | TMIGD3 (0.41) | SMN1; SMN2ALDH1A1LMNAHTTNPC1 | |
| SCHEMBL20975164 | 0.78 | HDAC1 (0.43) | SMN1; SMN2LMNANPC1RAB9AFAAH | |
| SCHEMBL26212252 | 0.78 | SERPINA3 (0.47) | SMN1; SMN2ALDH1A1LMNAHTTNPC1 |
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-2017191297-A1 | ADENINE DERIVATIVES AS PROTEIN KINASE INHIBITORS | BCI PHARMA (FR) | 2017-11-09 | — | — | WO | disclosed |