Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 4/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | AR | P10275 | 5/20 | 0.47 |
| ▸ | IDO1 | P14902 | 4/20 | 0.45 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.41 |
| ▸ | SOS2 | Q07890 | 1/20 | 0.40 |
| ▸ | MPO | P05164 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | RXFP3 | Q9NSD7 | 1/20 | 0.38 |
| ▸ | HAT1 | O14929 | 1/20 | 0.38 |
| ▸ | EP300 | Q09472 | 1/20 | 0.38 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.36 |
| ▸ | TUBB | P07437 | 2/20 | 0.36 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.36 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.36 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.36 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.36 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1399281 | 0.92 | HTR2A (0.58) | HTR2AMAPTSMN1; SMN2NPSR1AR | |
| SCHEMBL1399335 | 0.88 | HTR2A (0.59) | HTR2AMAPTSMN1; SMN2NPSR1AR | |
| SCHEMBL1399393 | 0.87 | HTR2A (0.43) | HTR2AMAPTSMN1; SMN2NPSR1AR | |
| SCHEMBL1399386 | 0.87 | MPO (0.56) | HTR2AMAPTSMN1; SMN2NPSR1IDO1 | |
| SCHEMBL1399495 | 0.85 | HTR2A (0.59) | HTR2AMAPTSMN1; SMN2NPSR1IDO1 | |
| SCHEMBL1399208 | 0.84 | AR (0.47) | HTR2AMAPTSMN1; SMN2NPSR1AR | |
| SCHEMBL1399252 | 0.81 | IDO1 (0.48) | HTR2AMAPTSMN1; SMN2NPSR1IDO1 | |
| SCHEMBL1399442 | 0.81 | HTR2A (0.55) | HTR2AMAPTIDO1TRPM8MPO | |
| SCHEMBL1399206 | 0.80 | HTR2A (0.58) | HTR2AMAPTSMN1; SMN2NPSR1AR | |
| SCHEMBL1399487 | 0.78 | HTR2A (0.65) | HTR2AMAPTNPSR1IDO1TRPM8 |
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 |