Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 6/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | TSPO | P30536 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28618652 | 0.83 | ESR2 (0.46) | TACR1MEN1CYP2C9CYP2C19KMT2A | |
| SCHEMBL832849 | 0.81 | EPHX1 (0.46) | CYP2C19SLC6A2TAAR1MAOASLC6A4 | |
| SCHEMBL9852879 | 0.75 | SLC6A2 (0.51) | SLC6A2SLC6A4SLC6A3SIGMAR1 | |
| SCHEMBL27993268 | 0.74 | SLC6A2 (0.55) | TACR1SLC6A2TAAR1MAOASLC6A4 | |
| SCHEMBL11754330 | 0.73 | ALDH1A1 (0.54) | CYP2C19L3MBTL1CYP1A2 | |
| SCHEMBL28878316 | 0.72 | TAAR1 (0.42) | TACR1KDM4EMEN1POLBMAPT | |
| SCHEMBL11867747 | 0.71 | KDM4E (0.45) | TACR1KDM4EMEN1POLBMAPT | |
| SCHEMBL22798139 | 0.71 | CYP1A2 (0.48) | SLC6A2TAAR1MAOASLC6A4SLC6A3 | |
| SCHEMBL7452482 | 0.70 | EPHX1 (0.42) | MEN1POLBCYP2C9CYP2C19KMT2A | |
| SCHEMBL5658415 | 0.70 | ESR1 (0.56) | MEN1POLBCYP2C9CYP2C19KMT2A |
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-105408326-B | It is used to prepare the novel method of Spiroheterocyclic pyrrolidine dione | 先正达参股股份有限公司 | 2019-08-27 | — | — | CN | disclosed |