Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 14/20 | 0.72 |
| ▸ | HDAC2 | Q92769 | 14/20 | 0.72 |
| ▸ | HDAC3 | O15379 | 12/20 | 0.72 |
| ▸ | HDAC4 | P56524 | 12/20 | 0.72 |
| ▸ | HDAC7 | Q8WUI4 | 12/20 | 0.72 |
| ▸ | HDAC10 | Q969S8 | 12/20 | 0.72 |
| ▸ | HDAC11 | Q96DB2 | 12/20 | 0.72 |
| ▸ | HDAC8 | Q9BY41 | 12/20 | 0.72 |
| ▸ | HDAC6 | Q9UBN7 | 12/20 | 0.72 |
| ▸ | HDAC9 | Q9UKV0 | 12/20 | 0.72 |
| ▸ | HDAC5 | Q9UQL6 | 12/20 | 0.72 |
| ▸ | MMP3 | P08254 | 1/20 | 0.56 |
| ▸ | RARB | P10826 | 3/20 | 0.55 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.53 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL7738398 | 1.00 | HDAC1 (0.72) | HDAC1HDAC2HDAC3HDAC4HDAC7 | |
| SCHEMBL7737575 | 0.98 | HDAC1 (0.69) | HDAC1HDAC2HDAC3HDAC4HDAC7 | |
| SCHEMBL10361085 | 0.90 | HDAC1 (0.65) | HDAC1HDAC2HDAC3HDAC4HDAC7 | |
| SCHEMBL14413930 | 0.88 | MMP3 (0.66) | HDAC1HDAC2HDAC3HDAC4HDAC7 | |
| SCHEMBL15061644 | 0.88 | HDAC1 (0.62) | HDAC1HDAC2HDAC3HDAC4HDAC7 | |
| SCHEMBL7374757 | 0.88 | HDAC1 (0.78) | HDAC1HDAC2HDAC3HDAC4HDAC7 | |
| SCHEMBL3381443 | 0.87 | HDAC3 (0.77) | HDAC1HDAC2HDAC3HDAC4HDAC7 | |
| SCHEMBL7515225 | 0.87 | HDAC3 (0.77) | HDAC1HDAC2HDAC3HDAC4HDAC7 | |
| SCHEMBL1007408 | 0.87 | HDAC3 (0.77) | HDAC1HDAC2HDAC3HDAC4HDAC7 | |
| SCHEMBL8823916 | 0.85 | HDAC1 (0.64) | HDAC1HDAC2HDAC3HDAC4HDAC7 |
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-6743777-B1 | TRISPHENYL ACYL DERIVATIVES OF THE ECHINOCANDIN CLASS; CANDIDA ALBICANS; ANTIFUNGAL AND ANTIPARASITIC; CYCLIC HEXAPEPTIDES HAVING UNIQUE SIDE CHAIN ACYL GROUP | ELI LILLY AND COMPANY | 2004-06-01 | — | — | US | disclosed |