Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | CASP7 | P55210 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | RXRB | P28702 | 3/20 | 0.31 |
| ▸ | RXRA | P19793 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
| ▸ | RXRG | P48443 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28301996 | 0.86 | NR1I2 (0.31) | — | |
| SCHEMBL13293024 | 0.83 | RXRB (0.42) | TDP1MAPTHSD17B10RXRBRXRA | |
| SCHEMBL13293083 | 0.83 | CA9 (0.34) | MAPTSMN1; SMN2RXRBRXRAMEN1 | |
| SCHEMBL6355129 | 0.76 | RXRB (0.42) | TDP1MAPTHSD17B10RXRBRXRA | |
| SCHEMBL5471913 | 0.76 | SMN1; SMN2 (0.35) | MAPTSMN1; SMN2RXRBRXRAMEN1 | |
| SCHEMBL13293062 | 0.75 | NR1I2 (0.31) | ALDH1A1 | |
| SCHEMBL6353449 | 0.74 | GABRA1 (0.33) | RXRBRXRARXRG | |
| SCHEMBL14625971 | 0.73 | KDM4E (0.39) | MAPTRXRBRXRAMEN1ALDH1A1 | |
| SCHEMBL22205095 | 0.73 | CYP1A2 (0.46) | TDP1CYP3A4MAPTMAPK1HSD17B10 | |
| SCHEMBL31107047 | 0.71 | GABRA1 (0.33) | TDP1ALOX15HSD17B10ALDH1A1 |
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-109942585-A | A kind of novel organic semi-conductor material, preparation method, FET device and preparation method thereof | 兰州大学 | 2019-06-28 | — | — | CN | disclosed |