Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 5/20 | 0.58 |
| ▸ | HTR1D | P28221 | 5/20 | 0.58 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.54 |
| ▸ | IDO1 | P14902 | 8/20 | 0.53 |
| ▸ | TUBB4A | P04350 | 4/20 | 0.53 |
| ▸ | TUBB | P07437 | 4/20 | 0.53 |
| ▸ | TUBA3C | P0DPH7 | 4/20 | 0.53 |
| ▸ | TUBA1B | P68363 | 4/20 | 0.53 |
| ▸ | TUBA4A | P68366 | 4/20 | 0.53 |
| ▸ | TUBB4B | P68371 | 4/20 | 0.53 |
| ▸ | TUBB3 | Q13509 | 4/20 | 0.53 |
| ▸ | TUBB2A | Q13885 | 4/20 | 0.53 |
| ▸ | TUBB8 | Q3ZCM7 | 4/20 | 0.53 |
| ▸ | TUBA3E | Q6PEY2 | 4/20 | 0.53 |
| ▸ | TUBA1A | Q71U36 | 4/20 | 0.53 |
| ▸ | TUBA1C | Q9BQE3 | 4/20 | 0.53 |
| ▸ | TUBB6 | Q9BUF5 | 4/20 | 0.53 |
| ▸ | TUBB2B | Q9BVA1 | 4/20 | 0.53 |
| ▸ | TUBB1 | Q9H4B7 | 4/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL1399487 | 0.91 | HTR2A (0.65) | HTR2AHTR1DTRPM8IDO1TUBB4A | |
| SCHEMBL4633080 | 0.91 | HTR2A (0.58) | HTR2AHTR1DTRPM8IDO1TUBB4A | |
| SCHEMBL1399308 | 0.91 | HTR2A (0.58) | HTR2AHTR1DTRPM8IDO1TUBB4A | |
| SCHEMBL1399490 | 0.88 | IDO1 (0.59) | HTR2AHTR1DTRPM8IDO1TUBB4A | |
| SCHEMBL1399504 | 0.86 | MPO (0.58) | HTR2ATRPM8IDO1TUBB4ATUBB | |
| SCHEMBL1399242 | 0.85 | HTR2A (0.60) | HTR2AHTR1DTRPM8IDO1TUBB4A | |
| SCHEMBL1399442 | 0.84 | HTR2A (0.55) | HTR2AHTR1DTRPM8IDO1TUBB4A | |
| SCHEMBL4633964 | 0.84 | HTR2A (0.54) | HTR2AHTR1DTRPM8IDO1TUBB4A | |
| SCHEMBL1399173 | 0.83 | IDO1 (0.53) | HTR2AHTR1DIDO1TUBB4ATUBB | |
| SCHEMBL1399216 | 0.81 | IDO1 (0.62) | HTR2AHTR1DTRPM8IDO1TUBB4A |
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-1860100-B1 | 2-(1H-indolylsulfanyl)-benzyl amine derivatives as SSRI | LUNDBECK & CO AS H (DK) | 2011-03-02 | — | — | EP | claimed |