Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.71 |
| ▸ | NOTUM | Q6P988 | 4/20 | 0.68 |
| ▸ | MAPT | P10636 | 5/20 | 0.67 |
| ▸ | MEN1 | O00255 | 1/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.63 |
| ▸ | NPC1 | O15118 | 4/20 | 0.62 |
| ▸ | RAB9A | P51151 | 4/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.61 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.59 |
| ▸ | POLB | P06746 | 2/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.57 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.57 |
| ▸ | RELA | Q04206 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL308295 | 0.85 | NOTUM (0.74) | TSHRNOTUMMAPTMEN1KMT2A | |
| SCHEMBL8593659 | 0.84 | NOTUM (0.79) | TSHRNOTUMMAPTMEN1KMT2A | |
| SCHEMBL14817503 | 0.84 | TSHR (0.67) | TSHRNOTUMMAPTMEN1KMT2A | |
| SCHEMBL13041447 | 0.84 | TSHR (0.67) | TSHRNOTUMMAPTMEN1KMT2A | |
| SCHEMBL307374 | 0.84 | TSHR (0.71) | TSHRNOTUMMAPTMEN1KMT2A | |
| SCHEMBL18793809 | 0.83 | TSHR (0.75) | TSHRNOTUMMAPTMEN1KMT2A | |
| SCHEMBL5006023 | 0.83 | TSHR (0.75) | TSHRNOTUMMAPTMEN1KMT2A | |
| SCHEMBL23723711 | 0.83 | TSHR (0.69) | TSHRNOTUMMAPTMEN1KMT2A | |
| SCHEMBL10202736 | 0.82 | TSHR (0.63) | TSHRNOTUMMAPTMEN1KMT2A | |
| SCHEMBL1546073 | 0.81 | TSHR (0.77) | TSHRNOTUMMAPTMEN1KMT2A |
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-2021098737-A1 | FUSED HETEROCYCLIC DERIVATIVE AND USE THEREOF | 上海枢境生物科技有限公司 | 2021-05-27 | — | — | WO | disclosed |