Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APLNR | P35414 | 4/20 | 0.38 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.37 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.33 |
| ▸ | ACACB | O00763 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | FPR2 | P25090 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1145058 | 0.77 | GABRA1 (0.39) | APLNRDGAT1GABRA1GABRB1KDM4E | |
| SCHEMBL31079293 | 0.77 | GABRA1 (0.46) | APLNRDGAT1GABRA1GABRB1KDM4E | |
| SCHEMBL12261433 | 0.77 | GABRA1 (0.46) | APLNRDGAT1GABRA1GABRB1KDM4E | |
| SCHEMBL15332748 | 0.76 | PDE2A (0.44) | APLNRDGAT1GABRA1GABRB1KDM4E | |
| SCHEMBL15464206 | 0.75 | APLNR (0.38) | APLNRDGAT1GABRA1GABRB1KDM4E | |
| SCHEMBL16545023 | 0.75 | APLNR (0.38) | APLNRDGAT1GABRA1GABRB1KDM4E | |
| SCHEMBL4940040 | 0.75 | APLNR (0.39) | APLNRDGAT1AAK1 | |
| SCHEMBL18367829 | 0.74 | APLNR (0.46) | APLNRDGAT1AAK1KDM4EPYCR1 | |
| SCHEMBL18367830 | 0.74 | APLNR (0.46) | APLNRDGAT1AAK1KDM4EPYCR1 | |
| SCHEMBL20238210 | 0.73 | PDE2A (0.43) | APLNRDGAT1GABRA1GABRB1PYCR1 |
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-2011020806-A1 | 3-AMINO-5-PHENYL-5,6-DIHYDRO-2H-[1,4]OXAZINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2011-02-24 | — | — | WO | disclosed |