Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.38 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | CASP3 | P42574 | 2/20 | 0.36 |
| ▸ | SENP8 | Q96LD8 | 2/20 | 0.36 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.36 |
| ▸ | SENP6 | Q9GZR1 | 2/20 | 0.36 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28546185 | 0.84 | SMN1; SMN2 (0.42) | ADORA3ALDH1A1NPC1SMN1; SMN2MAPT | |
| SCHEMBL28538276 | 0.84 | SMN1; SMN2 (0.50) | ADORA3ADORA1NR3C1ALDH1A1NPC1 | |
| SCHEMBL28910782 | 0.77 | NPC1 (0.38) | ALDH1A1NPC1SMN1; SMN2MAPTKDM4E | |
| SCHEMBL28548203 | 0.74 | SMN1; SMN2 (0.44) | ADORA3ADORA2AADORA1ALDH1A1NPC1 | |
| SCHEMBL28532820 | 0.74 | SMN1; SMN2 (0.47) | ADORA3ADORA1ALDH1A1NPC1SMN1; SMN2 | |
| SCHEMBL28537620 | 0.73 | NPC1 (0.42) | ALDH1A1NPC1SMN1; SMN2MAPTKDM4E | |
| SCHEMBL10426454 | 0.67 | GCGR (0.44) | ALDH1A1NPC1SMN1; SMN2KDM4ERAB9A | |
| SCHEMBL10425291 | 0.66 | NPC1 (0.39) | ALDH1A1NPC1SMN1; SMN2MAPTKDM4E | |
| SCHEMBL15349276 | 0.66 | ALKBH5 (0.34) | ALDH1A1NPC1SMN1; SMN2MAPTKDM4E | |
| SCHEMBL15349476 | 0.65 | ALKBH5 (0.40) | PTGDR2NPC1MAPTKDM4ERAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-109810112-B | Preparation method of indolo [2,1-a ] phthalazine derivative | 华侨大学 | 2021-03-23 | — | — | CN | disclosed |