Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 9/20 | 0.55 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.48 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.47 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.47 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.47 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.44 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.44 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL20865568 | 0.89 | LMNA (0.57) | GAALMNASMN1; SMN2KAT6ACA1 | |
| SCHEMBL4500941 | 0.87 | PDK1 (0.59) | RORCSIRT2SIRT1GAAPDK1 | |
| SCHEMBL30849775 | 0.87 | PDK1 (0.59) | RORCSIRT2SIRT1GAAPDK1 | |
| SCHEMBL26273989 | 0.82 | LMNA (0.54) | GAAPDK1PDK2PDK3PDK4 | |
| SCHEMBL16396241 | 0.81 | SMN1; SMN2 (0.51) | GAALMNASMN1; SMN2KCNJ6KCNJ5 | |
| SCHEMBL20132311 | 0.79 | CA1 (0.51) | RORCLMNAKAT6ACA1CA2 | |
| SCHEMBL1186595 | 0.78 | CA1 (0.69) | CA1CA2MAPT | |
| SCHEMBL29919407 | 0.78 | CA1 (0.53) | RORCLMNASMN1; SMN2KAT6ACA1 | |
| SCHEMBL11644560 | 0.78 | CA1 (0.64) | GAALMNASMN1; SMN2CA1CA2 | |
| SCHEMBL21597810 | 0.77 | CA1 (0.52) | RORCLMNASMN1; SMN2KAT6ACA1 |
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-105283443-B | Hete rocyclic derivatives and application thereof | 株式会社C&C新药研究所 | 2018-08-17 | — | — | CN | disclosed |