Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.40 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.39 |
| ▸ | TUBB | P07437 | 2/20 | 0.39 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.39 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.39 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.39 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.39 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.39 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.39 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.39 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.39 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.39 |
| ▸ | TUBA1C | Q9BQE3 | 2/20 | 0.39 |
| ▸ | TUBB6 | Q9BUF5 | 2/20 | 0.39 |
| ▸ | TUBB2B | Q9BVA1 | 2/20 | 0.39 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27308285 | 0.81 | L3MBTL1 (0.43) | ALDH1A1KDM4EHSP90AA1HPGDNPSR1 | |
| SCHEMBL14983694 | 0.80 | NPC1 (0.45) | ADORA3ADORA2ATUBB4ATUBBTUBA3C | |
| SCHEMBL11982021 | 0.77 | SMN1; SMN2 (0.49) | TP53ALDH1A1KDM4ENPC1MAPT | |
| SCHEMBL12716146 | 0.75 | TUBB4A (0.47) | TP53ADORA3ADORA2AADORA1TUBB4A | |
| SCHEMBL27717967 | 0.74 | NPC1 (0.42) | ADORA3ADORA2AADORA1ALDH1A1KDM4E | |
| SCHEMBL10091158 | 0.72 | NPC1 (0.44) | TP53TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL27296101 | 0.71 | TUBB4A (0.41) | ADORA3ADORA2AADORA1TUBB4ATUBB | |
| SCHEMBL27441536 | 0.71 | NPC1 (0.43) | TUBB4ATUBBTUBA3CTUBA1BTUBA4A | |
| SCHEMBL26062505 | 0.71 | F7 (0.39) | TP53ADORA3ADORA2AADORA1ALDH1A1 | |
| SCHEMBL5125304 | 0.70 | ALDH1A1 (0.60) | TP53ALDH1A1KDM4ENPC1MAPT |
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-1039645-C | 1,3-(substd. thio) acetoxy Melbamycinum derivatives, their preparation method, and use in agricultural chemistry | SANKYO CO (JP) | 1998-09-02 | — | — | CN | disclosed |