Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.36 |
| ▸ | GABRD | O14764 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.36 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.36 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 6/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5168846 | 0.78 | GRM2 (0.37) | ADRB2SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL5170529 | 0.77 | HDAC1 (0.39) | SMN1; SMN2SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL5171838 | 0.77 | CYP2D6 (0.47) | SMN1; SMN2SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL5171729 | 0.76 | NPSR1 (0.44) | GABRDGABRA1GABRB1GABRA5GABRA3 | |
| SCHEMBL28060870 | 0.75 | OPRM1 (0.33) | KMT2A | |
| SCHEMBL5170560 | 0.75 | NR3C1 (0.40) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL1035119 | 0.74 | PPIA (0.42) | ADRB2SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL5170237 | 0.73 | AKR1C3 (0.33) | SMN1; SMN2ALDH1A1HPGDLMNA | |
| SCHEMBL22499953 | 0.73 | KDM4E (0.32) | KMT2A | |
| SCHEMBL27953254 | 0.73 | SLC6A2 (0.43) | SMN1; SMN2GABRDGABRA1GABRB1GABRA5 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1776357-A1 | HYDROXYAMIDE COMPOUNDS HAVING ACTIVITY AS INHIBITORS OF HISTONE DEACETYLASE (HDAC) | Astellas Pharma Inc. (JP) | 2007-04-25 | — | — | EP | disclosed |
| WO-2006016680-A1 | HYDROXYAMIDE COMPOUNDS HAVING ACTIVITY AS INHIBITORS OF HISTONE DEACETYLASE (HDAC) | ASTELLAS PHARMA INC. (JP) | 2006-02-16 | — | — | WO | disclosed |