Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 8/20 | 0.65 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | ALB | P02768 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 3/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | BCL2 | P10415 | 2/20 | 0.38 |
| ▸ | THRB | P10828 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8463269 | 0.77 | ALB (0.61) | AKR1B1ALBALDH1A1MCL1SMN1; SMN2 | |
| SCHEMBL28259842 | 0.76 | AKR1B1 (0.69) | AKR1B1ALBALDH1A1MCL1SMN1; SMN2 | |
| SCHEMBL2622264 | 0.76 | AKR1B1 (1.00) | AKR1B1ALBALDH1A1MCL1SMN1; SMN2 | |
| SCHEMBL2622269 | 0.71 | AKR1B1 (0.64) | AKR1B1ALBALDH1A1MCL1SMN1; SMN2 | |
| SCHEMBL2622277 | 0.70 | AKR1B1 (0.58) | AKR1B1ALDH1A1MCL1SMN1; SMN2KDM4E | |
| SCHEMBL415683 | 0.69 | ERN1 (0.57) | ACHEALDH1A1SMN1; SMN2KDM4EMEN1 | |
| 6,6'-Methoxygossypol SCHEMBL2622265 | 0.68 | AKR1B1 (1.00) | AKR1B1ALBALDH1A1MCL1SMN1; SMN2 | |
| SCHEMBL22700470 | 0.68 | AKR1B1 (0.85) | AKR1B1ALBALDH1A1MCL1SMN1; SMN2 | |
| SCHEMBL11436443 | 0.67 | ACHE (0.54) | ACHEALDH1A1SMN1; SMN2POLBGAA | |
| SCHEMBL22700467 | 0.66 | AKR1B1 (0.70) | AKR1B1ALBALDH1A1MCL1SMN1; SMN2 |
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-105884596-B | Hemigossypol and vergosin derivative and their preparation and the application on pesticide | 南开大学 | 2019-03-29 | — | — | CN | disclosed |