Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.69 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.46 |
| ▸ | PDE2A | O00408 | 1/20 | 0.46 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.43 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.43 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | BMI1 | P35226 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | GALR3 | O60755 | 1/20 | 0.41 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL15605424 | 0.82 | TSHR (1.00) | TSHRMAPK1HTTPIK3CDPIK3CA | |
| SCHEMBL19486460 | 0.79 | TSHR (0.82) | TSHRMAPK1HTTPIK3CDPIK3CA | |
| SCHEMBL13080878 | 0.78 | TSHR (0.73) | TSHRMAPK1HTTPIK3CDPIK3CA | |
| SCHEMBL1104833 | 0.77 | MAPK1 (0.77) | TSHRMAPK1HTTPIK3CDPIK3CA | |
| SCHEMBL1104811 | 0.76 | MAPK1 (0.70) | TSHRMAPK1HTTPIK3CDPIK3CA | |
| SCHEMBL22507435 | 0.76 | TSHR (0.56) | TSHRMAPK1HTTPDE10AALDH1A1 | |
| SCHEMBL13052935 | 0.75 | TSHR (0.74) | TSHRMAPK1HTTPIK3CDPIK3CA | |
| SCHEMBL24848710 | 0.74 | TSHR (0.68) | TSHRMAPK1HTTPIK3CDPIK3CA | |
| SCHEMBL19486091 | 0.74 | TSHR (0.67) | TSHRMAPK1HTTPDE10APDE2A | |
| SCHEMBL6565325 | 0.74 | TSHR (0.67) | TSHRMAPK1HTTPIK3CDPIK3CA |
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-2017178864-A1 | SEVEN-MEMBERED RING COMPOUNDS | IDEMITSU KOSAN CO., LTD. (JP) | 2017-10-19 | — | — | WO | disclosed |