Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 10/20 | 0.41 |
| ▸ | DRD3 | P35462 | 10/20 | 0.41 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.39 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.39 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.39 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 2/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 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 | |
|---|---|---|---|---|
| SCHEMBL24570948 | 0.77 | HTR2C (0.40) | DRD2DRD3CYP19A1MAOB | |
| SCHEMBL8688588 | 0.76 | DRD2 (0.51) | DRD2DRD3ABCC9ABCC8KCNJ11 | |
| SCHEMBL4479260 | 0.76 | MAOB (0.34) | DRD3CYP2D6TSHRKDM1AMAOA | |
| SCHEMBL4676940 | 0.71 | DRD2 (0.44) | DRD2DRD3ABCC9ABCC8KCNJ11 | |
| SCHEMBL4875328 | 0.70 | DRD2 (0.67) | DRD2DRD3ABCC9ABCC8KCNJ11 | |
| SCHEMBL4699946 | 0.69 | DRD2 (0.45) | DRD2DRD3ABCC9ABCC8KCNJ11 | |
| SCHEMBL169166 | 0.69 | MEN1 (0.32) | CYP19A1 | |
| SCHEMBL15810322 | 0.68 | KDM4E (0.41) | DRD2DRD3CYP19A1 | |
| SCHEMBL16412900 | 0.67 | DRD2 (0.50) | DRD2DRD3ABCC9ABCC8KCNJ11 | |
| SCHEMBL6540021 | 0.67 | DRD2 (0.50) | DRD2DRD3ABCC9ABCC8KCNJ11 |
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-2017065419-A1 | ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME | ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) | 2017-04-20 | — | — | WO | disclosed |