Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 10/20 | 0.41 |
| ▸ | NOS3 | P29474 | 7/20 | 0.41 |
| ▸ | ANPEP | P15144 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | AADAT | Q8N5Z0 | 4/20 | 0.33 |
| ▸ | GOT1 | P17174 | 1/20 | 0.33 |
| ▸ | KYAT1 | Q16773 | 1/20 | 0.33 |
| ▸ | KYAT3 | Q6YP21 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19129357 | 0.76 | KMT2A (0.41) | KMT2ANOS2NOS3CES1 | |
| SCHEMBL817973 | 0.76 | ACHE (0.46) | KMT2ANOS2NOS3CES1 | |
| SCHEMBL11533284 | 0.72 | KMT2A (0.49) | KMT2ANOS2NOS3 | |
| SCHEMBL11536198 | 0.72 | KMT2A (0.42) | KMT2ANOS2NOS3CES1 | |
| SCHEMBL28525591 | 0.71 | KMT2A (0.44) | KMT2ANOS2NOS3 | |
| SCHEMBL3293542 | 0.68 | NPC1 (0.40) | KMT2ANOS2NOS3CES1 | |
| SCHEMBL13851468 | 0.63 | KMT2A (0.68) | KMT2ANOS2NOS3CES1 | |
| SCHEMBL8936321 | 0.63 | CES1 (0.48) | KMT2ANOS2NOS3CES1 | |
| SCHEMBL3063845 | 0.63 | ACHE (0.59) | ANPEPAADATGOT1KYAT1KYAT3 | |
| Hydrochloric Acid SCHEMBL7130904 | 0.61 | ACHE (0.57) | ANPEPAADATGOT1KYAT1KYAT3 |
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-111836807-A | Oxaspiro compounds, preparation method and application thereof | 四川科伦博泰生物医药股份有限公司 | 2020-10-27 | — | — | CN | disclosed |