Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDO2 | P48775 | 1/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.47 |
| ▸ | USP7 | Q93009 | 1/20 | 0.47 |
| ▸ | DHFR | P00374 | 1/20 | 0.46 |
| ▸ | PGR | P06401 | 1/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL398850 | 0.82 | ALDH1A1 (0.58) | TDO2ALOX5DHFRPGRADORA2A | |
| SCHEMBL29575632 | 0.82 | ALDH1A1 (0.58) | TDO2ALOX5DHFRPGRADORA2A | |
| SCHEMBL3785880 | 0.81 | MAP4K4 (0.50) | USP7ALDH1A1KDM4EMAPTMAP4K4 | |
| SCHEMBL6250190 | 0.80 | PIK3CA (0.45) | TDO2ALOX5USP7DHFRPGR | |
| SCHEMBL6261652 | 0.80 | PGR (0.48) | TDO2ALOX5USP7DHFRPGR | |
| SCHEMBL21933948 | 0.79 | ALDH1A1 (0.50) | TDO2ALOX5DHFRPGRADORA2A | |
| SCHEMBL565298 | 0.78 | ALDH1A1 (0.62) | ALOX5ADORA2AALDH1A1TSHRALOX15 | |
| SCHEMBL30646075 | 0.78 | ALDH1A1 (0.62) | ALOX5ADORA2AALDH1A1TSHRALOX15 | |
| SCHEMBL25582792 | 0.78 | ALOX5 (0.55) | ALOX5DHFRPGRESR2PIK3CA | |
| SCHEMBL30485727 | 0.78 | IKBKB (0.41) | ALDH1A1TSHRNPC1RAB9AKDM4E |
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-113264894-A | Benzoxazole derivative and preparation method thereof | 陕西维世诺新材料有限公司 | 2021-08-17 | — | — | CN | disclosed |