Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | TTR | P02766 | 2/20 | 0.36 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.35 |
| ▸ | SELE | P16581 | 1/20 | 0.35 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.32 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.32 |
| ▸ | MAP3K8 | P41279 | 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 | |
|---|---|---|---|---|
| SCHEMBL28351542 | 0.87 | MAP3K8 (0.39) | NPC1RAB9AICAM1SELEVCAM1 | |
| SCHEMBL28348631 | 0.87 | HSD11B1 (0.40) | MAPTICAM1SELEALDH1A1 | |
| SCHEMBL28351620 | 0.86 | RARB (0.41) | MAPTICAM1SELEALDH1A1 | |
| SCHEMBL28352075 | 0.86 | RARB (0.41) | MAPTICAM1SELEALDH1A1 | |
| SCHEMBL28348408 | 0.86 | RARB (0.41) | MAPTICAM1SELEALDH1A1 | |
| SCHEMBL28348622 | 0.86 | RARB (0.41) | MAPTICAM1SELEALDH1A1 | |
| SCHEMBL28348588 | 0.86 | RARB (0.41) | MAPTICAM1SELEALDH1A1 | |
| SCHEMBL28348158 | 0.75 | ESR1 (0.38) | NPC1RAB9AMAPTPKMESR1 | |
| SCHEMBL28348703 | 0.74 | RAB9A (0.36) | NPC1RAB9AMAPTMAPKAPK2TP53 | |
| SCHEMBL13437634 | 0.73 | LTA4H (0.55) | RAB9ATP53 |
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-110734452-A | semiconductor materials, and preparation method and application thereof | 北京大学深圳研究生院 | 2020-01-31 | — | — | CN | disclosed |