Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | ACSS2 | Q9NR19 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | ITK | Q08881 | 1/20 | 0.37 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.37 |
| ▸ | BTK | Q06187 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5230034 | 0.87 | NPC1 (0.40) | ALDH1A1SMN1; SMN2MAPTACSS2KDM4E | |
| SCHEMBL5226357 | 0.87 | HDAC6 (0.48) | ALDH1A1MAPTKDM4EHSD17B10HPGD | |
| SCHEMBL4982539 | 0.86 | ALDH1A1 (0.42) | ALDH1A1SMN1; SMN2MAPTACSS2KDM4E | |
| SCHEMBL5226340 | 0.86 | HDAC6 (0.39) | ALDH1A1SMN1; SMN2MAPTKDM4EHSD17B10 | |
| SCHEMBL5224099 | 0.84 | GCGR (0.38) | ALDH1A1MAPTKDM4EHSD17B10HPGD | |
| SCHEMBL5226510 | 0.83 | MAPT (0.54) | ALDH1A1SMN1; SMN2MAPTKDM4ENPC1 | |
| SCHEMBL5224606 | 0.77 | KDR (0.37) | ALDH1A1SMN1; SMN2ACSS2KDM4EHSD17B10 | |
| SCHEMBL5230055 | 0.77 | BRAF (0.39) | ALDH1A1SMN1; SMN2MAPTKDM4EHSD17B10 | |
| SCHEMBL14274200 | 0.76 | HDAC6 (0.41) | ALDH1A1MAPTKDM4EHSD17B10HPGD | |
| SCHEMBL4980289 | 0.76 | HDAC6 (0.41) | ALDH1A1ACSS2KDM4EF2HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1487824-B1 | DIAMINO-PYRIMIDINES AND THEIR USE AS ANGIOGENESIS INHIBITORS | SMITHKLINE BEECHAM CORP (US) | 2007-06-20 | — | — | EP | disclosed |