Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 9/20 | 0.43 |
| ▸ | MAOA | P21397 | 2/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.32 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11072633 | 0.84 | ESR1 (0.42) | SLC6A4MAOAPTGS2PBRM1ESR1 | |
| SCHEMBL7379356 | 0.83 | ESR1 (0.33) | MAOAMAOBPBRM1ESR1ESR2 | |
| SCHEMBL12303200 | 0.81 | SLC6A4 (0.44) | SLC6A4MAOA | |
| SCHEMBL18602333 | 0.81 | SLC6A4 (0.44) | SLC6A4MAOA | |
| SCHEMBL171729 | 0.80 | PTGS2 (0.42) | SLC6A4MAOAPTGS2HTR2AHTR2C | |
| SCHEMBL1104208 | 0.79 | SLC6A4 (0.50) | SLC6A4MAOA | |
| SCHEMBL12303213 | 0.76 | MAPK1 (0.33) | — | |
| SCHEMBL626140 | 0.75 | ACHE (0.44) | LMNAPBRM1ESR1ESR2 | |
| SCHEMBL13175896 | 0.74 | SLC6A4 (0.53) | SLC6A4MAOAPTGS2MAOBTAS1R3 | |
| SCHEMBL25343596 | 0.73 | ADRB2 (0.45) | LMNAPBRM1ESR1ESR2 |
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-3207043-B3 | DIHYDROPYRROLOPYRIDINE INHIBITORS OF ROR-GAMMA | VITAE PHARMACEUTICALS LLC (US) | 2019-10-02 | — | — | EP | disclosed |