Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 4/20 | 0.42 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 6/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 4/20 | 0.38 |
| ▸ | CHIA | Q9BZP6 | 3/20 | 0.38 |
| ▸ | CHIT1 | Q13231 | 2/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | CHI3L1 | P36222 | 1/20 | 0.36 |
| ▸ | CHI3L2 | Q15782 | 1/20 | 0.36 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11071936 | 0.84 | SLC6A4 (0.39) | OPRM1OPRL1DRD2DRD3 | |
| SCHEMBL11074078 | 0.79 | GRIN2B (0.40) | GRIN2BSLC18A3OPRM1OPRL1CHIA | |
| Ethylbenzene SCHEMBL11069833 | 0.79 | OPRL1 (0.47) | OPRM1OPRL1 | |
| SCHEMBL11069648 | 0.78 | GRIN2B (0.47) | GRIN2BSLC18A3OPRM1OPRL1CHIA | |
| SCHEMBL11069677 | 0.76 | HTR1D (0.37) | OPRM1DRD2DRD3CYP2D6 | |
| SCHEMBL11066830 | 0.74 | OPRL1 (0.46) | GRIN2BSLC18A3OPRM1OPRL1CHIA | |
| SCHEMBL11065445 | 0.72 | OPRM1 (0.58) | GRIN2BSLC18A3OPRM1OPRL1CHIA | |
| SCHEMBL1967143 | 0.72 | GRIN2B (0.63) | GRIN2BSLC18A3OPRM1CHIASIGMAR1 | |
| SCHEMBL11073158 | 0.72 | OPRM1 (0.50) | GRIN2BOPRM1OPRL1DRD2DRD3 | |
| SCHEMBL11071916 | 0.71 | OPRM1 (0.38) | OPRM1OPRL1CYP2D6 |
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 |