Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.51 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.51 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.49 |
| ▸ | CDC25B | P30305 | 5/20 | 0.48 |
| ▸ | CDC25A | P30304 | 1/20 | 0.48 |
| ▸ | CDC25C | P30307 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL20763779 | 0.91 | TSHR (0.66) | TSHRHSD17B10ALDH1A1CYP1A2MEN1 | |
| SCHEMBL19849652 | 0.89 | TSHR (0.53) | TSHRHSD17B10ALDH1A1MEN1MAPT | |
| SCHEMBL29634134 | 0.89 | TSHR (0.53) | TSHRHSD17B10ALDH1A1MEN1MAPT | |
| Diethyl Phthalate SCHEMBL2173730 | 0.84 | TSHR (0.84) | TSHRHSD17B10ALDH1A1CYP3A4KMT2A | |
| SCHEMBL495814 | 0.84 | TSHR (0.84) | TSHRHSD17B10ALDH1A1CYP3A4KMT2A | |
| SCHEMBL11296630 | 0.83 | TSHR (0.63) | TSHRHSD17B10ALDH1A1CYP1A2MEN1 | |
| SCHEMBL28684512 | 0.83 | PTGER1 (0.52) | TSHRHSD17B10ALDH1A1MEN1MAPT | |
| SCHEMBL23689805 | 0.82 | TSHR (0.62) | TSHRHSD17B10ALDH1A1CYP1A2MEN1 | |
| SCHEMBL27744742 | 0.81 | TSHR (0.47) | TSHRHSD17B10ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL13117430 | 0.81 | TSHR (0.59) | TSHRHSD17B10ALDH1A1MEN1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019034172-A1 | COMPOUND HAVING PD-L1 INHIBITORY ACTIVITY, PREPARATION METHOD THEREFOR AND USE THEREOF | 上海轶诺药业有限公司 | 2019-02-21 | — | — | WO | disclosed |