Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.46 |
| ▸ | NAE1 | Q13564 | 8/20 | 0.42 |
| ▸ | UBA3 | Q8TBC4 | 8/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | APP | P05067 | 2/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | THPO | P40225 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL24286025 | 0.80 | NAE1 (0.44) | NAE1UBA3EGFRADORA1ADORA3 | |
| SCHEMBL22787563 | 0.79 | NAE1 (0.41) | NAE1UBA3LMNATSHRADORA2A | |
| SCHEMBL22787553 | 0.78 | NAE1 (0.41) | NAE1UBA3 | |
| SCHEMBL22787487 | 0.78 | AURKA (0.47) | NAE1UBA3 | |
| SCHEMBL22787565 | 0.75 | NAE1 (0.39) | NAE1UBA3 | |
| SCHEMBL22787549 | 0.73 | NAE1 (0.41) | SLC29A1NAE1UBA3MAPK1HTT | |
| SCHEMBL22787478 | 0.72 | NAE1 (0.61) | NAE1UBA3 | |
| SCHEMBL24286193 | 0.70 | NAE1 (0.43) | SLC29A1NAE1UBA3MAPK1HTT | |
| SCHEMBL22787540 | 0.68 | NAE1 (0.42) | NAE1UBA3MAPTRAB9A | |
| SCHEMBL22787468 | 0.68 | NAE1 (0.42) | NAE1UBA3MAPTRAB9A |
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-3985007-A1 | TRIAZOLOPYRIMIDINE COMPOUND AND SALT, COMPOSITION AND USE THEREOF | Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) | 2022-04-20 | — | — | EP | disclosed |