Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.43 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.43 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.43 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.43 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.43 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.43 |
| ▸ | GPR84 | Q9NQS5 | 12/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.38 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL18825093 | 0.90 | GRIN2D (0.47) | ALDH1A1L3MBTL1MAPTTDP1GRIN2D | |
| SCHEMBL18825080 | 0.82 | CYP3A4 (0.48) | ALDH1A1MAPTTDP1GPR84CYP3A4 | |
| SCHEMBL27762914 | 0.79 | GRIN2D (0.42) | ALDH1A1L3MBTL1MAPTTDP1GRIN2D | |
| SCHEMBL22547495 | 0.71 | GPR84 (0.67) | GPR84KMT2A | |
| SCHEMBL3416258 | 0.70 | FBP1 (0.49) | ALDH1A1MAPTGRIN2DGRIN3BGRIN1 | |
| SCHEMBL8160462 | 0.70 | GPR84 (0.70) | GPR84KMT2A | |
| SCHEMBL1277858 | 0.69 | RAB9A (0.52) | ALDH1A1L3MBTL1MAPTGRIN2DGRIN3B | |
| SCHEMBL2768879 | 0.69 | FBP1 (0.64) | ALDH1A1MAPTGRIN2DGRIN3BGRIN1 | |
| SCHEMBL28923795 | 0.69 | KCNH2 (0.50) | ALDH1A1MAPTKMT2A | |
| SCHEMBL9015135 | 0.68 | GPR84 (0.45) | GPR84KMT2A |
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-2017077307-A1 | THERAPY AND PHARMACEUTICAL COMPOSITION | UNIVERSITY OF SOUTHAMPTON (GB) | 2017-05-11 | — | — | WO | disclosed |
| WO-2017077307-A1 | THERAPY AND PHARMACEUTICAL COMPOSITION | UNIVERSITY OF SOUTHAMPTON (GB) | 2017-05-11 | — | — | WO | disclosed |