Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 1/20 | 0.49 |
| ▸ | RXRB | P28702 | 1/20 | 0.49 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | COPS5 | Q92905 | 1/20 | 0.45 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.45 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.45 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.41 |
| ▸ | TTR | P02766 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16749638 | 0.83 | CA12 (0.48) | MEN1KMT2AGAADAOTTR | |
| SCHEMBL27766830 | 0.82 | GAA (0.59) | MEN1KMT2AGAAFFAR1HDAC1 | |
| SCHEMBL27633124 | 0.81 | ALDH1A1 (0.64) | RXRARXRBMEN1KMT2AGAA | |
| SCHEMBL28069551 | 0.81 | PTGS1 (0.50) | FFAR1DAO | |
| SCHEMBL28851716 | 0.80 | MRGPRX4 (0.54) | MRGPRX4FFAR1FFAR4TAAR1 | |
| SCHEMBL11684208 | 0.78 | RXRA (0.46) | RXRARXRBMRGPRX4POLBMEN1 | |
| SCHEMBL27646690 | 0.77 | CA1 (0.58) | MRGPRX4POLBFFAR1 | |
| SCHEMBL28170053 | 0.77 | MRGPRX4 (0.49) | MRGPRX4FFAR1HDAC1DAO | |
| SCHEMBL11687234 | 0.76 | RXRA (0.45) | RXRARXRBMRGPRX4POLBMEN1 | |
| SCHEMBL14166175 | 0.76 | DHODH (0.56) | RXRARXRBMEN1KMT2AGAA |
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-105777756-A | Heteroaryl compound and application thereof in medicines | 广东东阳光药业有限公司 | 2016-07-20 | — | — | CN | disclosed |