Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | GFER | P55789 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | RAF1 | P04049 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 4/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | DAO | P14920 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | KIT | P10721 | 1/20 | 0.32 |
| ▸ | IDH1 | O75874 | 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 | |
|---|---|---|---|---|
| SCHEMBL28300152 | 0.87 | RAB9A (0.41) | RAB9AALDH1A1HPGDGFERGAA | |
| SCHEMBL28873510 | 0.84 | RAB9A (0.55) | RAB9AALDH1A1HPGDGFERGAA | |
| SCHEMBL28298682 | 0.81 | ALDH1A1 (0.56) | RAB9AALDH1A1HPGDGFERGAA | |
| SCHEMBL28298714 | 0.80 | RAF1 (0.41) | RAB9AALDH1A1HPGDGFERGAA | |
| SCHEMBL28300148 | 0.74 | RAF1 (0.42) | RAB9AALDH1A1HPGDGFERGAA | |
| SCHEMBL28563606 | 0.73 | RAB9A (0.44) | RAB9AALDH1A1HPGDGFERGAA | |
| SCHEMBL28300209 | 0.72 | RAF1 (0.45) | RAB9AALDH1A1HPGDGFERGAA | |
| SCHEMBL28300137 | 0.71 | RAF1 (0.39) | RAB9AALDH1A1HPGDGFERGAA | |
| SCHEMBL28196767 | 0.71 | GAA (0.54) | ALDH1A1GAARAF1MAPTHSD17B10 | |
| SCHEMBL28571204 | 0.70 | ALDH1A1 (0.42) | RAB9AALDH1A1HPGDGFERGAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-109963858-A | N3The thieno uracil and application thereof that ring-type replaces | 拜耳股份公司 | 2019-07-02 | — | — | CN | disclosed |