Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.48 |
| ▸ | DRD2 | P14416 | 6/20 | 0.45 |
| ▸ | DRD3 | P35462 | 3/20 | 0.45 |
| ▸ | DRD4 | P21917 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.39 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.39 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20883770 | 0.82 | ALDH1A1 (0.46) | SLC18A3DRD2DRD3CYP2D6KMT2A | |
| SCHEMBL22542112 | 0.82 | DRD2 (0.43) | DRD2DRD3DRD4SLC6A4 | |
| SCHEMBL14924437 | 0.82 | SLC6A2 (0.42) | DRD2DRD4CYP2D6MAPK11MAPK14 | |
| SCHEMBL22542116 | 0.81 | DRD4 (0.45) | DRD2DRD3DRD4KMT2A | |
| SCHEMBL22547351 | 0.80 | SIGMAR1 (0.44) | DRD2DRD3DRD4SLC6A4 | |
| SCHEMBL8289625 | 0.78 | CHRNB2 (0.41) | ALDH1A1HPGDSLC6A4 | |
| SCHEMBL22542093 | 0.78 | DRD4 (0.45) | DRD2DRD3DRD4KMT2AALDH1A1 | |
| SCHEMBL22542097 | 0.77 | DRD2 (0.38) | DRD2DRD3DRD4MAPT | |
| SCHEMBL12320891 | 0.77 | SLC18A3 (0.67) | SLC18A3DRD2DRD3DRD4 | |
| SCHEMBL22542120 | 0.76 | CALCA (0.39) | SLC18A3ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020210377-A1 | HETEROCYCLIC COMPOUNDS AND USES THEREOF | NUVATION BIO INC. (US) | 2020-10-15 | — | — | WO | disclosed |
| WO-2020210383-A1 | HETEROCYCLIC COMPOUNDS AND USES THEREOF | NUVATION BIO INC. (US) | 2020-10-15 | — | — | WO | disclosed |