Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP2 | P50579 | 13/20 | 0.64 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.64 |
| ▸ | METAP1 | P53582 | 1/20 | 0.64 |
| ▸ | IDO1 | P14902 | 7/20 | 0.63 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.63 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.50 |
| ▸ | JAK2 | O60674 | 1/20 | 0.49 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.49 |
| ▸ | PAK4 | O96013 | 1/20 | 0.49 |
| ▸ | PIM1 | P11309 | 1/20 | 0.49 |
| ▸ | KDR | P35968 | 1/20 | 0.49 |
| ▸ | GSK3B | P49841 | 1/20 | 0.49 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL29626826 | 0.78 | METAP2 (1.00) | METAP2NOTUMMETAP1IDO1KEAP1 | |
| SCHEMBL104083 | 0.78 | METAP2 (0.64) | METAP2NOTUMMETAP1IDO1KEAP1 | |
| SCHEMBL28070596 | 0.78 | METAP2 (1.00) | METAP2NOTUMMETAP1IDO1KEAP1 | |
| SCHEMBL8221447 | 0.77 | METAP2 (1.00) | METAP2NOTUMMETAP1IDO1KEAP1 | |
| SCHEMBL28741959 | 0.76 | METAP2 (0.61) | METAP2NOTUMMETAP1IDO1KEAP1 | |
| SCHEMBL5025520 | 0.76 | IDO1 (1.00) | METAP2NOTUMMETAP1IDO1KEAP1 | |
| SCHEMBL8664138 | 0.76 | METAP2 (0.95) | METAP2NOTUMMETAP1IDO1KEAP1 | |
| SCHEMBL1030506 | 0.74 | METAP2 (0.63) | METAP2NOTUMMETAP1IDO1KEAP1 | |
| SCHEMBL28741785 | 0.74 | IDO1 (0.65) | METAP2NOTUMMETAP1IDO1KEAP1 | |
| SCHEMBL28855935 | 0.74 | METAP2 (0.68) | METAP2NOTUMMETAP1IDO1KEAP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105062502-B | Liquid-crystal compounds and its preparation method and use containing penta azacyclo | 华南师范大学 | 2017-08-25 | — | — | CN | disclosed |
| CN-105062502-A | Liquid crystal compound containing five membered nitrogen-containing heterocycles, as well as synthesizing method and application thereof | UNIV SOUTH CHINA NORMAL | 2015-11-18 | — | — | CN | disclosed |