Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | KIF11 | P52732 | 1/20 | 0.39 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.39 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.39 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | LPL | P06858 | 2/20 | 0.39 |
| ▸ | LIPG | Q9Y5X9 | 2/20 | 0.39 |
| ▸ | DRD2 | P14416 | 2/20 | 0.39 |
| ▸ | DRD1 | P21728 | 2/20 | 0.39 |
| ▸ | DRD4 | P21917 | 2/20 | 0.39 |
| ▸ | DRD5 | P21918 | 2/20 | 0.39 |
| ▸ | DRD3 | P35462 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL380954 | 0.88 | CNR1 (0.50) | CNR1CNR2MEN1KMT2AKIF11 | |
| SCHEMBL1337579 | 0.83 | MEN1 (0.40) | MEN1KMT2AGRIN2DGRIN3BGRIN1 | |
| SCHEMBL31455995 | 0.81 | TP53 (0.48) | CNR1CNR2MEN1KMT2AKIF11 | |
| SCHEMBL12345521 | 0.81 | TP53 (0.48) | KIF11GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL589019 | 0.81 | TP53 (0.48) | CNR1CNR2MEN1KMT2AKIF11 | |
| SCHEMBL5424543 | 0.81 | MTNR1A (0.47) | CNR1CNR2MEN1KMT2AKIF11 | |
| SCHEMBL25382633 | 0.79 | MAOA (0.56) | CNR1CNR2KIF11SIGMAR1DRD2 | |
| SCHEMBL28409443 | 0.79 | LPL (0.53) | CNR1CNR2LPLLIPG | |
| SCHEMBL13890311 | 0.78 | PDK2 (0.41) | CNR1CNR2MEN1KMT2AKIF11 | |
| SCHEMBL28644935 | 0.77 | TAAR1 (0.63) | DRD2DRD1DRD4DRD5DRD3 |
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-2020112846-A1 | SMALL MOLECULE MODULATORS OF SIGMA-1 AND SIGMA-2 RECEPTORS AND USES THEREOF | NORTHWESTERN UNIVERSITY (US) | 2020-06-04 | — | — | WO | disclosed |