Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.55 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.55 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.55 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.55 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.55 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.55 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.55 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.55 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.55 |
| ▸ | KMO | O15229 | 4/20 | 0.54 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.50 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.49 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL5849219 | 0.98 | HDAC3 (0.58) | TSHRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL5848843 | 0.96 | TSHR (0.55) | TSHRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL727064 | 0.89 | TSHR (0.59) | TSHRKMOHSD11B1SRD5A2 | |
| SCHEMBL6361425 | 0.86 | HDAC3 (0.51) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL5255149 | 0.86 | POLB (0.51) | TSHRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL5255144 | 0.86 | KMO (0.50) | TSHRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL11039973 | 0.84 | KMO (0.49) | TSHRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL7389548 | 0.84 | KMO (0.49) | TSHRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL1448283 | 0.84 | HSD17B3 (0.59) | TSHRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL14775644 | 0.84 | TSHR (0.52) | TSHRHDAC3HDAC4HDAC1HDAC7 |
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 |
|---|---|---|---|---|---|---|---|
| US-20050100902-A1 | 5-cyano-1h-indole derivatives as antagonist of the inerleukine-8 receptors | LABORATORIES FOURNIER S.A. (FR) | 2005-05-12 | — | — | US | disclosed |