Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 7/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 5/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | USP14 | P54578 | 1/20 | 0.33 |
| ▸ | EDNRA | P25101 | 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 | |
|---|---|---|---|---|
| SCHEMBL22760100 | 0.92 | SMN1; SMN2 (0.40) | NOTUMHPGDSMN1; SMN2ALDH1A1RAB9A | |
| SCHEMBL22747853 | 0.90 | MAPT (0.42) | NOTUMHPGDALDH1A1KDM4EMEN1 | |
| SCHEMBL22747828 | 0.90 | NOTUM (0.39) | NOTUMHPGDSMN1; SMN2ALDH1A1NPC1 | |
| SCHEMBL22760499 | 0.90 | NOTUM (0.37) | NOTUMHPGDSMN1; SMN2ALDH1A1NPC1 | |
| SCHEMBL22747830 | 0.88 | EDNRA (0.39) | HPGDALDH1A1NPC1HSD17B10KDM4E | |
| SCHEMBL22760063 | 0.88 | EDNRA (0.39) | HPGDALDH1A1NPC1HSD17B10KDM4E | |
| SCHEMBL22760126 | 0.88 | EDNRA (0.41) | NOTUMHPGDSMN1; SMN2ALDH1A1NPC1 | |
| SCHEMBL22760500 | 0.88 | HPGD (0.35) | HPGDSMN1; SMN2ALDH1A1RAB9AHSD17B10 | |
| SCHEMBL22748355 | 0.87 | EDNRA (0.40) | HPGDSMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL22760477 | 0.87 | NOTUM (0.37) | NOTUMHPGDSMN1; SMN2ALDH1A1NPC1 |
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-2020244462-A1 | INDOLE DERIVATIVES AND PHARMACEUTICAL USE THEREOF | 中国药科大学 | 2020-12-10 | — | — | WO | disclosed |