Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.32 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.32 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.32 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.32 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.32 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7555398 | 1.00 | ESR1 (0.40) | ESR1MGLLCA12CA1CA2 | |
| SCHEMBL7560193 | 1.00 | ESR1 (0.40) | ESR1MGLLCA12CA1CA2 | |
| SCHEMBL7553069 | 1.00 | ESR1 (0.40) | ESR1MGLLCA12CA1CA2 | |
| SCHEMBL7553288 | 0.76 | HDAC1 (0.31) | HDAC1HDAC2 | |
| SCHEMBL7553540 | 0.76 | HDAC1 (0.31) | HDAC1HDAC2 | |
| SCHEMBL7555200 | 0.76 | HDAC1 (0.31) | HDAC1HDAC2 | |
| SCHEMBL7558645 | 0.76 | HDAC1 (0.31) | HDAC1HDAC2 | |
| SCHEMBL7552498 | 0.74 | MEN1 (0.46) | HDAC1HDAC2HDAC8 | |
| SCHEMBL7552728 | 0.74 | HPGD (0.46) | HDAC1HDAC2HDAC8 | |
| SCHEMBL7559525 | 0.74 | HPGD (0.46) | HDAC1HDAC2HDAC8 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1219631-A1 | ANTIANDROGEN AGENTS | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2002-07-03 | — | — | EP | disclosed |