Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 8/20 | 0.51 |
| ▸ | HDAC7 | Q8WUI4 | 8/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 8/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.51 |
| ▸ | CA1 | P00915 | 3/20 | 0.51 |
| ▸ | CA2 | P00918 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | KIF11 | P52732 | 1/20 | 0.49 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.46 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.46 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.46 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.46 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.46 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.46 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11097805 | 0.83 | KIF11 (0.54) | CA1CA2ALDH1A1KIF11PDK1 | |
| SCHEMBL29091743 | 0.81 | KIF11 (0.53) | CA1CA2ALDH1A1KIF11PDK1 | |
| SCHEMBL26624042 | 0.80 | CA1 (0.56) | HDAC1HDAC7HDAC8HDAC6CA1 | |
| SCHEMBL17577313 | 0.80 | CA1 (0.56) | HDAC1HDAC7HDAC8HDAC6CA1 | |
| SCHEMBL10646962 | 0.79 | CA1 (0.41) | HDAC1HDAC7HDAC8HDAC6CA1 | |
| SCHEMBL8846991 | 0.78 | HDAC1 (0.72) | HDAC1HDAC7HDAC8HDAC6CA1 | |
| SCHEMBL12788587 | 0.78 | L3MBTL1 (0.73) | CA1CA2ALDH1A1KIF11HPGD | |
| SCHEMBL11036752 | 0.76 | HPGD (0.56) | CA1CA2ALDH1A1KIF11HPGD | |
| SCHEMBL26623072 | 0.75 | MDM2 (0.52) | HDAC1HDAC7HDAC8HDAC6CA1 | |
| SCHEMBL10648232 | 0.74 | HDAC1 (0.76) | HDAC1HDAC7HDAC8HDAC6CA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7550458-B2 | Tricycloundecane compounds useful as modulators of nuclear hormone receptor function | BRISTOL-MYERS SQUIBB COMPANY (US) | 2009-06-23 | — | — | US | disclosed |
| US-7550458-B2 | Tricycloundecane compounds useful as modulators of nuclear hormone receptor function | BRISTOL-MYERS SQUIBB COMPANY (US) | 2009-06-23 | — | — | US | disclosed |