Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 11/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.33 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.33 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.32 |
| ▸ | CACNA1D | Q01668 | 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 | |
|---|---|---|---|---|
| SCHEMBL5793923 | 0.90 | IDO1 (0.44) | IDO1NR3C2CYP2C19 | |
| SCHEMBL5791679 | 0.88 | CHRM3 (0.39) | TACR1SLC6A4SLC6A3IDO1KDM4E | |
| SCHEMBL5791672 | 0.86 | TACR1 (0.46) | TACR1SLC6A4SLC6A3IDO1KDM4E | |
| SCHEMBL5792856 | 0.86 | SLC1A3 (0.44) | TACR1SLC6A4SLC6A3IDO1KDM4E | |
| SCHEMBL5794077 | 0.85 | TACR1 (0.47) | TACR1CACNA1FCACNA1DCACNA1SCACNA1C | |
| SCHEMBL5790217 | 0.83 | TACR1 (0.57) | TACR1IDO1CACNA1FCACNA1DCACNA1S | |
| SCHEMBL5790274 | 0.80 | IDO1 (0.45) | TACR1IDO1KDM4ELMNAMAPK1 | |
| SCHEMBL5793829 | 0.80 | IDO1 (0.42) | SLC6A4SLC6A3IDO1KDM4ELMNA | |
| SCHEMBL5793858 | 0.80 | CHRNB2 (0.47) | SLC6A4IDO1LMNAMAPK1KMT2A | |
| SCHEMBL5790287 | 0.80 | SLC6A4 (0.44) | TACR1SLC6A4SLC6A3IDO1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006014942-A1 | ARYLOXYALKYLAMINE NK-1/SSRI INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2006-02-09 | — | — | WO | disclosed |