Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD1 | P17405 | 6/20 | 0.49 |
| ▸ | CNR1 | P21554 | 12/20 | 0.44 |
| ▸ | CNR2 | P34972 | 10/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.38 |
| ▸ | HDAC5 | Q9UQL6 | 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 | |
|---|---|---|---|---|
| SCHEMBL28820544 | 0.99 | SMPD1 (0.48) | SMPD1CNR1CNR2 | |
| SCHEMBL28820551 | 0.96 | SMPD1 (0.44) | SMPD1CNR1CNR2 | |
| SCHEMBL28820569 | 0.82 | SMPD1 (0.50) | SMPD1CNR1CNR2HDAC3HDAC4 | |
| SCHEMBL28820557 | 0.80 | SMPD1 (0.48) | SMPD1CNR1CNR2 | |
| SCHEMBL28820635 | 0.78 | CNR1 (0.65) | SMPD1CNR1CNR2 | |
| SCHEMBL28820525 | 0.77 | CNR1 (0.66) | CNR1CNR2 | |
| SCHEMBL28820549 | 0.76 | CNR1 (0.66) | CNR1CNR2 | |
| SCHEMBL28820728 | 0.74 | CNR1 (0.67) | SMPD1CNR1CNR2 | |
| SCHEMBL28820553 | 0.74 | CNR1 (0.64) | SMPD1CNR1CNR2 | |
| SCHEMBL28948773 | 0.72 | CNR1 (0.65) | CNR1CNR2 |
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-109516955-B | Nitrogen-containing five-membered aromatic heterocyclic compound and preparation method and application thereof | 华东师范大学 | 2022-07-26 | — | — | CN | claimed |
| CN-109516955-B | Nitrogen-containing five-membered aromatic heterocyclic compound and preparation method and application thereof | 华东师范大学 | 2022-07-26 | — | — | CN | disclosed |