Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | FDPS | P14324 | 1/20 | 0.39 |
| ▸ | FDFT1 | P37268 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17571434 | 1.00 | TSHR (0.43) | TSHRL3MBTL1MAPK1PTK2SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL19435312 | 0.98 | TSHR (0.42) | TSHRL3MBTL1MAPK1PTK2SMN1; SMN2 | |
| SCHEMBL17559611 | 0.81 | TSHR (0.47) | TSHRL3MBTL1MAPK1PTK2SMN1; SMN2 | |
| SCHEMBL22678947 | 0.79 | L3MBTL1 (0.45) | TSHRL3MBTL1MAPK1PTK2SMN1; SMN2 | |
| SCHEMBL17571376 | 0.79 | L3MBTL1 (0.45) | TSHRL3MBTL1MAPK1PTK2SMN1; SMN2 | |
| SCHEMBL11294953 | 0.78 | HCAR3 (0.57) | TSHRL3MBTL1MAPK1PTK2SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL19435339 | 0.78 | ADRA2A (0.46) | TSHRL3MBTL1MAPK1PTK2SMN1; SMN2 | |
| SCHEMBL19455191 | 0.78 | L3MBTL1 (0.43) | TSHRL3MBTL1MAPK1PTK2SMN1; SMN2 | |
| SCHEMBL17571416 | 0.78 | L3MBTL1 (0.43) | TSHRL3MBTL1MAPK1PTK2SMN1; SMN2 | |
| SCHEMBL12497548 | 0.76 | PTK2 (0.56) | TSHRL3MBTL1MAPK1PTK2SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3189043-B1 | THERAPEUTIC COMPOUNDS AS INHIBITORS OF THE OREXIN-1 RECEPTOR | C4X DISCOVERY LTD (GB) | 2020-11-18 | — | — | EP | disclosed |