Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.39 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.35 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.35 |
| ▸ | ITGAL | P20701 | 1/20 | 0.35 |
| ▸ | TDO2 | P48775 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 2/20 | 0.35 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.32 |
| ▸ | TUBB | P07437 | 1/20 | 0.32 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.32 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.32 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Cadaverine Tartrate SCHEMBL736178 | 0.86 | HTR2A (0.50) | IDO1ITGB2ICAM1ITGALTDO2 | |
| Cadaverine Tartrate SCHEMBL736824 | 0.82 | RECQL (0.43) | IDO1ITGB2ICAM1ITGALTDO2 | |
| SCHEMBL735716 | 0.75 | HTR2A (0.62) | IDO1GPR84HTR2AHTR6HTR1A | |
| SCHEMBL736880 | 0.74 | IDO1 (0.49) | IDO1TDO2GPR84HTR2AHTR1A | |
| SCHEMBL757235 | 0.74 | IDO1 (0.52) | IDO1TDO2GPR84HTR2AHTR1A | |
| SCHEMBL736507 | 0.72 | IDO1 (0.49) | IDO1GPR84HTR2AHTR1ASLC6A4 | |
| SCHEMBL3190247 | 0.72 | HTR2A (0.50) | IDO1GPR84HTR2AHTR1ASLC6A4 | |
| SCHEMBL735392 | 0.72 | IDO1 (0.49) | IDO1GPR84HTR2AHTR1ASLC6A4 | |
| SCHEMBL4391470 | 0.72 | MPO (0.54) | IDO1ACHEGPR84HTR2AHTR6 | |
| SCHEMBL4381230 | 0.72 | CDK4 (0.43) | IDO1ACHEHTR2AHTR1ASLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-8138220-B2 | [2-(6-fluoro-1H-indol-3-ylsulfanyl)benzyl]methyl amine for the treatment of affective disorders | H. LUNDBECK A/S (DK) | 2012-03-20 | — | — | US | claimed |