Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 3/20 | 0.41 |
| ▸ | SLC6A9 | P48067 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | AURKA | O14965 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 3/20 | 0.36 |
| ▸ | CA9 | Q16790 | 3/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17202442 | 0.86 | PDK2 (0.46) | PDK2SLC6A9MEN1KMT2ANPC1 | |
| SCHEMBL29240214 | 0.81 | MAPT (0.43) | PDK2SLC6A9MEN1KMT2AHTT | |
| SCHEMBL23015352 | 0.81 | HDAC1 (0.45) | PDK2SLC6A9 | |
| SCHEMBL29190906 | 0.77 | HPGD (0.45) | PDK2MEN1KMT2AHTTNPC1 | |
| SCHEMBL29262509 | 0.77 | SLC6A9 (0.41) | PDK2SLC6A9 | |
| SCHEMBL14861471 | 0.74 | PDK2 (0.52) | PDK2SLC6A9ALDH1A1 | |
| SCHEMBL28901850 | 0.74 | PDK2 (0.38) | PDK2SLC6A9 | |
| SCHEMBL28901868 | 0.74 | HRH3 (0.41) | PDK2SLC6A9MEN1KMT2ANPC1 | |
| SCHEMBL28967182 | 0.72 | HPGD (0.41) | PDK2SLC6A9NPC1RAB9AALDH1A1 | |
| SCHEMBL17202416 | 0.71 | PDK2 (0.52) | PDK2SLC6A9MEN1KMT2AHTT |
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 |
|---|---|---|---|---|---|---|---|
| CN-114667145-A | Molecules that bind to TDP-43 for the treatment of amyotrophic lateral sclerosis and related disorders | 拜尔哈文制药股份有限公司 | 2022-06-24 | — | — | CN | disclosed |