Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH2 | P48735 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 6/20 | 0.38 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | BCR | P11274 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | LCK | P06239 | 1/20 | 0.34 |
| ▸ | TEK | Q02763 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9460648 | 0.74 | EGFR (0.41) | GRM5 | |
| SCHEMBL9460886 | 0.74 | TSHR (0.37) | GRM5MAPT | |
| SCHEMBL31395652 | 0.73 | IDH2 (0.66) | IDH2KIF11FFAR1MAPTRAPGEF4 | |
| SCHEMBL1420853 | 0.73 | IDH2 (0.66) | IDH2KIF11FFAR1MAPTRAPGEF4 | |
| Hydrochloric Acid SCHEMBL1426717 | 0.71 | IDH2 (0.64) | IDH2KIF11FFAR1MAPTRAPGEF4 | |
| SCHEMBL2884609 | 0.71 | TSHR (0.41) | TAS2R14GRM5MAPT | |
| Hydrochloric Acid SCHEMBL29734740 | 0.71 | IDH2 (0.64) | IDH2KIF11FFAR1MAPTRAPGEF4 | |
| SCHEMBL28300509 | 0.70 | GRM5 (0.52) | PTPN1GRM5FFAR1 | |
| SCHEMBL29794038 | 0.70 | GRM5 (0.52) | PTPN1GRM5FFAR1 | |
| SCHEMBL2892638 | 0.70 | HRH3 (0.44) | GRM5MAPT |
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-0383621-B1 | Diphenyldiacetylene derivative | TODA KOGYO CORP (JP) | 1993-12-08 | — | — | EP | disclosed |
| US-5196586-A | Polydiphenyldiacetylenes | TODA KOGYO CORP. (JP) | 1993-03-23 | — | — | US | disclosed |