Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 1/20 | 0.45 |
| ▸ | IDO1 | P14902 | 2/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | PTGER3 | P43115 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.38 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.37 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.37 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.37 |
| ▸ | ITGAL | P20701 | 1/20 | 0.37 |
| ▸ | PLK4 | O00444 | 2/20 | 0.37 |
| ▸ | AURKA | O14965 | 2/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.37 |
| ▸ | PAK4 | O96013 | 2/20 | 0.37 |
| ▸ | ABL1 | P00519 | 2/20 | 0.37 |
| ▸ | LCK | P06239 | 2/20 | 0.37 |
| ▸ | CSF1R | P07333 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1399253 | 0.95 | NR4A2 (0.49) | NR4A2IDO1SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL1399410 | 0.93 | SLC6A3 (0.49) | NR4A2IDO1SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL1399366 | 0.79 | ALDH1A1 (0.55) | NR4A2IDO1SLC6A4MAPTPTGER3 | |
| SCHEMBL1399364 | 0.77 | GFER (0.52) | NR4A2IDO1SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL1399287 | 0.76 | HPGD (0.48) | IDO1SLC6A4MAPTNPC1GPR84 | |
| SCHEMBL1399315 | 0.72 | IFNAR1 (0.51) | NR4A2IDO1SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL5908998 | 0.71 | IDO1 (0.40) | NR4A2IDO1SLC6A2SLC6A4PTGER3 | |
| SCHEMBL4385853 | 0.71 | TAAR1 (0.50) | NR4A2IDO1SLC6A2SLC6A4PTGER3 | |
| SCHEMBL1399293 | 0.70 | IFNAR1 (0.54) | IDO1SLC6A3SLC6A2SLC6A4MAPT | |
| SCHEMBL4389000 | 0.69 | IDO1 (0.46) | NR4A2IDO1SLC6A2SLC6A4MAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1701940-A1 | 2-(1H-INDOLYLSULFANYL)-BENZYL AMINE DERIVATIVES AS SSRI | H.Lundbeck A/S (DK) | 2006-09-20 | — | — | EP | disclosed |
| EP-1654247-A1 | ALKYNYL ARYL CARBOXAMIDES | Applied Research Systems ARS Holding N.V. (AN) | 2006-05-10 | — | — | EP | disclosed |
| WO-2005061455-A1 | 2-(1H-INDOLYLSULFANYL)-BENZYL AMINE DERIVATIVES AS SSRI | H. LUNDBECK A/S (DK) | 2005-07-07 | — | — | WO | disclosed |
| WO-2005012280-A1 | ALKYNYL ARYL CARBOXAMIDES | APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) | 2005-02-10 | — | — | WO | disclosed |