Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 12/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 11/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 6/20 | 0.43 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.34 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.34 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.34 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.34 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.34 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.34 |
| ▸ | CCR1 | P32246 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.33 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.33 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18794816 | 0.89 | SLC6A4 (0.42) | SLC6A3SLC6A4SLC6A2CYP2D6CYP3A4 | |
| SCHEMBL18794831 | 0.81 | DRD2 (0.38) | SLC6A3SLC6A4SLC6A2GRIN1GRIN2A | |
| SCHEMBL18822478 | 0.81 | DRD2 (0.38) | SLC6A3SLC6A4SLC6A2GRIN1GRIN2A | |
| SCHEMBL18822477 | 0.81 | DRD2 (0.38) | SLC6A3SLC6A4SLC6A2GRIN1GRIN2A | |
| SCHEMBL18794837 | 0.79 | SLC6A9 (0.38) | SLC6A3SLC6A4SLC6A2GRIN1GRIN2A | |
| SCHEMBL18794830 | 0.78 | GRIN1 (0.33) | SLC6A3SLC6A4SLC6A2GRIN1GRIN2A | |
| SCHEMBL18794833 | 0.76 | METAP2 (0.38) | GRIN1GRIN2A | |
| SCHEMBL18794813 | 0.76 | METAP2 (0.41) | GRIN1GRIN2APSEN1PSEN2APH1B | |
| SCHEMBL18794821 | 0.75 | P2RX7 (0.33) | GRIN1GRIN2APSEN1PSEN2APH1B | |
| SCHEMBL18794819 | 0.74 | GRIN1 (0.51) | GRIN1GRIN2ACYP2C9CXCR3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017070793-A1 | NOVEL FLUORINATED HETEROCYCLE DERIVATIVES AND THEIR USES AS THERAPEUTIC AGENTS | TRILLIUM THERAPEUTICS INC. (CA) | 2017-05-04 | — | — | WO | claimed |
| WO-2017070793-A1 | NOVEL FLUORINATED HETEROCYCLE DERIVATIVES AND THEIR USES AS THERAPEUTIC AGENTS | TRILLIUM THERAPEUTICS INC. (CA) | 2017-05-04 | — | — | WO | disclosed |
| WO-2017070793-A1 | NOVEL FLUORINATED HETEROCYCLE DERIVATIVES AND THEIR USES AS THERAPEUTIC AGENTS | TRILLIUM THERAPEUTICS INC. (CA) | 2017-05-04 | — | — | WO | disclosed |