Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1LG2 | Q9BQ51 | 2/20 | 0.38 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | NEK2 | P51955 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21739459 | 0.85 | CYP11B1 (0.47) | PDCD1LG2CD274KDM4EOPRM1OPRD1 | |
| SCHEMBL22053044 | 0.83 | KDM4E (0.36) | PDCD1LG2CD274KDM4EOPRM1OPRD1 | |
| SCHEMBL22256990 | 0.82 | PDCD1LG2 (0.42) | PDCD1LG2CD274KDM4EOPRM1OPRD1 | |
| SCHEMBL23866532 | 0.79 | CYP2D6 (0.44) | PDCD1LG2CD274TSHRLMNAALDH1A1 | |
| SCHEMBL24004532 | 0.79 | PDCD1LG2 (0.36) | PDCD1LG2CD274 | |
| SCHEMBL23501265 | 0.77 | PDCD1LG2 (0.37) | PDCD1LG2CD274NEK2 | |
| SCHEMBL15721209 | 0.77 | NEK2 (0.52) | KDM4ECHRM2CHRM3NEK2 | |
| SCHEMBL20661569 | 0.76 | KDM4E (0.42) | KDM4EOPRM1OPRD1OPRK1GAA | |
| SCHEMBL25060592 | 0.76 | FPR2 (0.36) | PDCD1LG2CD274KDM4EOPRM1OPRD1 | |
| SCHEMBL24992825 | 0.76 | TSHR (0.34) | KDM4EOPRM1OPRD1OPRK1GAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3831823-A1 | PREPARATION AND APPLICATION OF AROMATIC COMPOUND HAVING IMMUNOREGULATORY FUNCTION | Shanghai Ennovabio Pharmaceuticals Co., Ltd. (CN) | 2021-06-09 | — | — | EP | disclosed |
| WO-2020025030-A1 | PREPARATION AND APPLICATION OF AROMATIC COMPOUND HAVING IMMUNOREGULATORY FUNCTION | 上海轶诺药业有限公司 | 2020-02-06 | — | — | WO | disclosed |