Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CNR2 | P34972 | 12/20 | 0.42 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | JAK1 | P23458 | 1/20 | 0.40 |
| ▸ | TYK2 | P29597 | 1/20 | 0.40 |
| ▸ | JAK3 | P52333 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 3/20 | 0.38 |
| ▸ | NPY5R | Q15761 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11935303 | 1.00 | KMT2A (0.44) | KMT2ATDP1CNR2JAK2JAK1 | |
| SCHEMBL17090224 | 0.91 | CNR2 (0.40) | KMT2ACNR2BACE1BACE2NPY5R | |
| SCHEMBL11935322 | 0.91 | CNR2 (0.40) | KMT2ACNR2BACE1BACE2NPY5R | |
| SCHEMBL17090221 | 0.89 | CNR2 (0.51) | CNR2JAK2JAK1CNR1 | |
| SCHEMBL11935321 | 0.89 | CNR2 (0.51) | CNR2JAK2JAK1CNR1 | |
| SCHEMBL13564855 | 0.88 | KMT2A (0.46) | KMT2ACNR2BACE1CNR1ALDH1A1 | |
| SCHEMBL17090105 | 0.88 | KMT2A (0.46) | KMT2ACNR2BACE1CNR1ALDH1A1 | |
| SCHEMBL13565081 | 0.86 | CNR2 (0.39) | CNR2JAK2JAK1TYK2JAK3 | |
| SCHEMBL17089941 | 0.86 | CNR2 (0.39) | CNR2JAK2JAK1TYK2JAK3 | |
| SCHEMBL17090174 | 0.84 | CRHR1 (0.49) | CNR2NPY5R |
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 |
|---|---|---|---|---|---|---|---|
| US-9139518-B2 | Amine derivative having NPY Y5 receptor antagonistic activity | SHIONOGI & CO., LTD. (JP) | 2015-09-22 | — | — | US | disclosed |