Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5580041 | 0.81 | ALDH1A1 (0.57) | ALDH1A1CYP1A2HPGDHSD17B10L3MBTL1 | |
| SCHEMBL11083559 | 0.80 | ALDH1A1 (0.52) | ALDH1A1CYP1A2HPGDHSD17B10L3MBTL1 | |
| SCHEMBL11088115 | 0.77 | ALDH1A1 (0.58) | ALDH1A1CYP1A2HPGDHSD17B10HTT | |
| SCHEMBL513869 | 0.74 | ALDH1A1 (0.48) | ALDH1A1CYP1A2HPGDHSD17B10L3MBTL1 | |
| SCHEMBL8079249 | 0.74 | ALDH1A1 (0.51) | ALDH1A1CYP1A2HPGDHSD17B10L3MBTL1 | |
| SCHEMBL3393854 | 0.74 | ALDH1A1 (0.48) | ALDH1A1CYP1A2HPGDHSD17B10L3MBTL1 | |
| SCHEMBL17662413 | 0.74 | ALDH1A1 (0.40) | ALDH1A1CYP1A2HPGDHSD17B10L3MBTL1 | |
| SCHEMBL11082445 | 0.73 | HTT (0.70) | ALDH1A1CYP1A2HPGDHSD17B10L3MBTL1 | |
| SCHEMBL11083564 | 0.72 | HSD17B10 (0.51) | ALDH1A1CYP1A2HPGDHSD17B10L3MBTL1 | |
| SCHEMBL11079506 | 0.72 | KDM4E (0.55) | ALDH1A1CYP1A2HPGDHSD17B10L3MBTL1 |
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-3315531-A1 | 8-ARM POLYETHYLENE GLYCOL DERIVATIVE, MANUFACTURING METHOD AND MODIFIED BIO-RELATED SUBSTANCE THEREBY | Xiamen Sinopeg Biotech Co., Ltd. (CN) | 2018-05-02 | — | — | EP | disclosed |