Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 4/20 | 0.38 |
| ▸ | DRD2 | P14416 | 3/20 | 0.38 |
| ▸ | DRD4 | P21917 | 3/20 | 0.38 |
| ▸ | HTR1D | P28221 | 2/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | HTR1B | P28222 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | FYN | P06241 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7449308 | 0.87 | DRD3 (0.42) | DRD3DRD2DRD4HTR1AFYN | |
| SCHEMBL7446300 | 0.82 | DRD3 (0.41) | DRD3DRD2DRD4HTR1AFYN | |
| SCHEMBL7455248 | 0.81 | HTR1A (0.36) | DRD2SIGMAR1HTR1ASLC6A4 | |
| SCHEMBL7447043 | 0.80 | SLC6A4 (0.35) | DRD3DRD2DRD4ALDH1A1ESR1 | |
| SCHEMBL7448567 | 0.75 | — | — | |
| SCHEMBL7447784 | 0.74 | — | — | |
| SCHEMBL10934615 | 0.67 | — | — | |
| SCHEMBL7455755 | 0.66 | DRD2 (0.44) | DRD3DRD2DRD4HTR1DALDH1A1 | |
| SCHEMBL7450002 | 0.65 | KDM1A (0.42) | — | |
| SCHEMBL4754736 | 0.65 | — | — |
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-2000006536-A1 | HEXAHYDRO-NAPHTHALENONE OXIMES AND HYDRAZONES | WARNER-LAMBERT COMPANY (US) | 2000-02-10 | — | — | WO | disclosed |