Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.54 |
| ▸ | GALR2 | O43603 | 1/20 | 0.54 |
| ▸ | MITF | O75030 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | XBP1 | P17861 | 1/20 | 0.54 |
| ▸ | CCR6 | P51684 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL26631727 | 1.00 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2LMNANPSR1GALR2 | |
| SCHEMBL8070346 | 0.82 | PDGFRB (0.55) | ALDH1A1SMN1; SMN2LMNAHPGDKDM4E | |
| SCHEMBL13088438 | 0.82 | SMN1; SMN2 (0.64) | ALDH1A1SMN1; SMN2LMNANPSR1GALR2 | |
| SCHEMBL5072230 | 0.81 | ALDH1A1 (0.46) | ALDH1A1NPSR1KDM4EMAPTKMT2A | |
| SCHEMBL7474176 | 0.78 | LMNA (0.60) | ALDH1A1SMN1; SMN2LMNANPSR1GALR2 | |
| SCHEMBL14854666 | 0.78 | ALDH1A1 (0.60) | ALDH1A1SMN1; SMN2LMNANPSR1GALR2 | |
| SCHEMBL26631746 | 0.78 | NPSR1 (0.60) | ALDH1A1SMN1; SMN2LMNANPSR1GALR2 | |
| SCHEMBL5167545 | 0.78 | SMN1; SMN2 (0.56) | ALDH1A1SMN1; SMN2LMNANPSR1GALR2 | |
| SCHEMBL8954112 | 0.77 | SMN1; SMN2 (0.58) | ALDH1A1SMN1; SMN2LMNANPSR1GALR2 | |
| SCHEMBL2484847 | 0.77 | VCAM1 (0.57) | ALDH1A1LMNANPSR1POLBHPGD |
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-114981275-B | Tricyclic compound, preparation method and medical application thereof | 中国医药研究开发中心有限公司 | 2023-12-19 | — | — | CN | disclosed |