Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT2 | Q8IXJ6 | 9/20 | 0.54 |
| ▸ | SIRT1 | Q96EB6 | 9/20 | 0.54 |
| ▸ | SIRT3 | Q9NTG7 | 9/20 | 0.54 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.50 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.50 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | GHSR | Q92847 | 1/20 | 0.39 |
| ▸ | SIRT7 | Q9NRC8 | 3/20 | 0.38 |
| ▸ | SIRT6 | Q8N6T7 | 2/20 | 0.38 |
| ▸ | MLNR | O43193 | 1/20 | 0.38 |
| ▸ | SIRT5 | Q9NXA8 | 2/20 | 0.38 |
| ▸ | CTSD | P07339 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Caprolactam SCHEMBL6668448 | 0.83 | CRBN (0.67) | SIRT2SIRT1SIRT3FKBP5CRBN | |
| Dodecane SCHEMBL27688625 | 0.81 | CRBN (0.64) | SIRT2SIRT1SIRT3FKBP5CRBN | |
| Undecane SCHEMBL3414259 | 0.81 | CRBN (0.64) | SIRT2SIRT1SIRT3FKBP5CRBN | |
| SCHEMBL10732167 | 0.81 | FKBP5 (0.46) | SIRT2SIRT1SIRT3FKBP5CRBN | |
| Dodecane SCHEMBL28204455 | 0.79 | CRBN (0.67) | SIRT2SIRT1SIRT3FKBP5CRBN | |
| Caprolactam SCHEMBL28286059 | 0.79 | CRBN (0.73) | SIRT2SIRT1SIRT3FKBP5CRBN | |
| Caprolactam SCHEMBL29165574 | 0.78 | CRBN (0.59) | SIRT2SIRT1SIRT3FKBP5CRBN | |
| Caprolactam SCHEMBL28288208 | 0.78 | CRBN (0.59) | SIRT2SIRT1SIRT3FKBP5CRBN | |
| Hydrochloric Acid SCHEMBL11393078 | 0.77 | ALDH1A1 (0.50) | SIRT2SIRT1SIRT3ALDH1A1GHSR | |
| SCHEMBL931066 | 0.77 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2148856-A2 | CATALYTIC DEAMINATION FOR CARPROLACTAM PRODUCTION | Board of Trustees of Michigan State University (US) | 2010-02-03 | — | — | EP | disclosed |
| WO-2008103366-A2 | CATALYTIC DEAMINATION FOR CARPROLACTAM PRODUCTION | BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) | 2008-08-28 | — | — | WO | disclosed |