Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.34 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
| ▸ | NOS2 | P35228 | 1/20 | 0.34 |
| ▸ | HTR1B | P28222 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 4/20 | 0.31 |
| ▸ | DRD3 | P35462 | 4/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL11076134 | 0.81 | HTR1D (0.38) | HTR1DHTR1AHTR1B | |
| SCHEMBL11075507 | 0.80 | HTR1D (0.39) | HTR1DHTR1ANOS3NOS1NOS2 | |
| SCHEMBL11067219 | 0.80 | HTR1D (0.38) | HTR1DHTR1ANOS3NOS1NOS2 | |
| SCHEMBL11077463 | 0.79 | OPRM1 (0.46) | HTR1DHTR1ADRD2DRD3 | |
| SCHEMBL11070194 | 0.79 | HTR1D (0.37) | HTR1DHTR1ANOS3NOS1NOS2 | |
| SCHEMBL11076146 | 0.78 | HTR1D (0.36) | HTR1DHTR1ANOS3NOS1NOS2 | |
| SCHEMBL11075002 | 0.78 | HTR1D (0.36) | HTR1DHTR1AHTR1BALDH1A1MEN1 | |
| SCHEMBL11076941 | 0.76 | HTR1D (0.40) | HTR1DHTR1AHTR1BDRD2DRD3 | |
| SCHEMBL11073002 | 0.75 | KCNN4 (0.36) | HTR1DHTR1ANOS3NOS1NOS2 | |
| SCHEMBL11073738 | 0.74 | SLC6A3 (0.49) | NOS3NOS1NOS2DRD2DRD3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4447454-A | Analgetic compounds, compositions and process of treatment | THE UPJOHN COMPANY (US) | 1984-05-08 | — | — | US | disclosed |
| US-4113866-A | ANALGETIC COMPOUNDS, COMPOSITIONS AND PROCESS OF TREATMENT | THE UPJOHN COMPANY (US) | 1978-09-12 | — | — | US | disclosed |