Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | PTPRC | P08575 | 3/20 | 0.44 |
| ▸ | PTPN13 | Q12923 | 2/20 | 0.44 |
| ▸ | CTSL | P07711 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | PTPRA | P18433 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2255249 | 0.89 | ALDH1A1 (0.58) | ALDH1A1POLBKDM4EHSD17B10HPGD | |
| SCHEMBL11776401 | 0.83 | ALDH1A1 (0.69) | ALDH1A1POLBKDM4EMAPTMEN1 | |
| SCHEMBL6012277 | 0.81 | ALDH1A1 (0.51) | ALDH1A1POLBKDM4EHSD17B10HPGD | |
| SCHEMBL2259592 | 0.80 | GRIK1 (0.52) | ALDH1A1POLBKDM4EHSD17B10HPGD | |
| SCHEMBL1184638 | 0.79 | KDM4E (0.53) | ALDH1A1POLBKDM4EHSD17B10HPGD | |
| SCHEMBL12468432 | 0.76 | POLB (0.59) | ALDH1A1POLBKDM4EHSD17B10HPGD | |
| SCHEMBL12681646 | 0.76 | KDM4E (0.52) | ALDH1A1POLBKDM4EHSD17B10HPGD | |
| SCHEMBL1185705 | 0.76 | KDM4E (0.51) | ALDH1A1POLBKDM4EHSD17B10MAPT | |
| SCHEMBL29783185 | 0.73 | HSD17B10 (0.63) | ALDH1A1POLBKDM4EHSD17B10HPGD | |
| SCHEMBL12217649 | 0.73 | HSD17B10 (0.63) | ALDH1A1POLBKDM4EHSD17B10HPGD |
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-7998952-B2 | Thiolactams and uses thereof | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2011-08-16 | — | — | US | disclosed |