Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | CXCR2 | P25025 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL21623741 | 0.87 | PKM (0.39) | PKMHTTCXCR2TDP1MAPK1 | |
| SCHEMBL21623757 | 0.76 | ALDH1A1 (0.41) | PKMHTTTDP1SMN1; SMN2MEN1 | |
| SCHEMBL21623726 | 0.75 | MAPT (0.43) | SMN1; SMN2LMNAL3MBTL1 | |
| SCHEMBL21623773 | 0.75 | DAO (0.37) | MEN1KMT2ANPC1RIPK1 | |
| SCHEMBL21623737 | 0.72 | ADORA1 (0.38) | PKMHTTTDP1MAPK1SMN1; SMN2 | |
| SCHEMBL21627192 | 0.71 | KCNQ2 (0.54) | PKMTDP1MAPK1SMN1; SMN2MEN1 | |
| SCHEMBL21623736 | 0.69 | TSHR (0.37) | HTTTDP1MAPK1MEN1KMT2A | |
| SCHEMBL21623745 | 0.69 | SMN1; SMN2 (0.54) | PKMHTTTDP1SMN1; SMN2MDM2 | |
| SCHEMBL21623749 | 0.68 | ALDH1A1 (0.36) | PKMHTTTDP1SMN1; SMN2MEN1 | |
| SCHEMBL4058596 | 0.66 | KCNQ3 (0.56) | HTTTDP1MAPK1SMN1; SMN2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020016297-A1 | THIOETHERS AS MODULATORS OF KV7.2/KV7.3 CHANNELS | Universität Greifswald (DE) | 2020-01-23 | — | — | WO | disclosed |