Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A2 | P31213 | 2/20 | 0.51 |
| ▸ | CASP3 | P42574 | 1/20 | 0.47 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.47 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.47 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | ITK | Q08881 | 1/20 | 0.43 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.43 |
| ▸ | F2 | P00734 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | DAO | P14920 | 2/20 | 0.40 |
| ▸ | APEX1 | P27695 | 1/20 | 0.40 |
| ▸ | DDO | Q99489 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20465145 | 0.89 | F2 (0.54) | SRD5A2HSP90AA1ESR2TDP1ALDH1A1 | |
| Hydroxyamine SCHEMBL4796191 | 0.84 | NR4A2 (0.46) | CASP3SENP8SENP7SENP6ALDH1A1 | |
| Hydroxyamine SCHEMBL4807777 | 0.80 | CASP3 (0.50) | CASP3SENP8SENP7SENP6ITK | |
| Hydroxyamine SCHEMBL5144256 | 0.79 | KDM4A (0.50) | SRD5A2CASP3SENP8SENP7SENP6 | |
| SCHEMBL19997297 | 0.78 | CASP3 (0.50) | CASP3SENP8SENP7SENP6HSP90AA1 | |
| Hydroxyamine SCHEMBL5618267 | 0.78 | MRGPRX4 (0.46) | CASP3SENP8SENP7SENP6PTPN5 | |
| SCHEMBL6993972 | 0.77 | DAO (0.44) | ITKKDM4EDAODDOMAPT | |
| SCHEMBL5981755 | 0.77 | CASP3 (0.51) | CASP3SENP8SENP7SENP6HSP90AA1 | |
| Hydroxyamine SCHEMBL4802770 | 0.76 | TUBB4A (0.41) | CASP3SENP8SENP7SENP6SMN1; SMN2 | |
| Hydroxyamine SCHEMBL4796509 | 0.76 | LMNA (0.53) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007109178-A9 | INDOLE DERIVATIVES AS INHIBITORS OF HISTONE DEACETYLASE | PHARMACYCLICS INC (US) | 2008-10-16 | — | — | WO | claimed |
| WO-2007109178-A2 | INDOLE DERIVATIVES AS INHIBITORS OF HISTONE DEACETYLASE | PHARMACYCLICS, INC. (US) | 2007-09-27 | — | — | WO | claimed |
| WO-2008061160-A1 | USES OF SELECTIVE INHIBITORS OF HDAC8 FOR TREATMENT OF INFLAMMATORY CONDITIONS | PHARMACYCLICS, INC. (US) | 2008-05-22 | — | — | WO | disclosed |