Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 4/20 | 0.63 |
| ▸ | MEN1 | O00255 | 7/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.63 |
| ▸ | POLB | P06746 | 4/20 | 0.63 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.63 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.61 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.60 |
| ▸ | GFER | P55789 | 2/20 | 0.60 |
| ▸ | CASP6 | P55212 | 1/20 | 0.60 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.58 |
| ▸ | BLM | P54132 | 1/20 | 0.58 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.58 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 1/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 2/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL20837934 | 1.00 | AKR1B1 (0.63) | AKR1B1MEN1KMT2APOLBPSMD14 | |
| SCHEMBL6887329 | 0.93 | MEN1 (0.71) | AKR1B1MEN1KMT2APOLBPSMD14 | |
| SCHEMBL6887336 | 0.93 | MEN1 (0.71) | AKR1B1MEN1KMT2APOLBPSMD14 | |
| SCHEMBL7050939 | 0.90 | PTPN12 (0.62) | AKR1B1MEN1KMT2APOLBPSMD14 | |
| SCHEMBL7050943 | 0.90 | PTPN12 (0.62) | AKR1B1MEN1KMT2APOLBPSMD14 | |
| SCHEMBL17769046 | 0.90 | TAS2R14 (0.70) | MEN1KMT2APOLBPSMD14MAPT | |
| SCHEMBL20837903 | 0.88 | MEN1 (0.75) | AKR1B1MEN1KMT2APOLBPSMD14 | |
| SCHEMBL17779681 | 0.88 | MEN1 (0.75) | AKR1B1MEN1KMT2APOLBPSMD14 | |
| SCHEMBL18102843 | 0.87 | AKR1B1 (0.58) | AKR1B1MEN1KMT2APOLBPSMD14 | |
| SCHEMBL17769188 | 0.87 | PTPN12 (0.59) | AKR1B1MEN1KMT2APOLBPSMD14 |
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-2016080853-A1 | 2-THIOXOTHIAZOLIDIN-4-ONE DERIVATIVES ACTIVE AS TRANSTHYRETIN LIGANDS AND USES THEREOF | BSIM2 – BIOMOLECULAR SIMULATIONS LDA (PT) | 2016-05-26 | — | — | WO | disclosed |