Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.50 |
| ▸ | MAPT | P10636 | 5/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 7/20 | 0.49 |
| ▸ | TSHR | P16473 | 5/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | BLM | P54132 | 2/20 | 0.45 |
| ▸ | ATM | Q13315 | 2/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL31375 | 0.92 | ALDH1A1 (0.57) | ALDH1A1KDM4EMAPTTDP1GAA | |
| SCHEMBL17286821 | 0.85 | TDP1 (0.54) | ALDH1A1KDM4EMAPTTDP1GAA | |
| SCHEMBL17834039 | 0.85 | ALDH1A1 (0.51) | ALDH1A1KDM4EMAPTTDP1GAA | |
| SCHEMBL12809723 | 0.85 | ALDH1A1 (0.55) | ALDH1A1KDM4EMAPTTDP1GAA | |
| SCHEMBL24325204 | 0.84 | TDP1 (0.52) | ALDH1A1KDM4EMAPTTDP1GAA | |
| SCHEMBL17341035 | 0.84 | TDP1 (0.52) | ALDH1A1KDM4EMAPTTDP1GAA | |
| SCHEMBL12825096 | 0.84 | ALDH1A1 (0.50) | ALDH1A1KDM4EMAPTTDP1GAA | |
| SCHEMBL20886708 | 0.84 | ALDH1A1 (0.50) | ALDH1A1KDM4EMAPTTDP1GAA | |
| SCHEMBL13925658 | 0.84 | TDP1 (0.52) | ALDH1A1KDM4EMAPTTDP1GAA | |
| SCHEMBL7602857 | 0.83 | ALDH1A1 (0.51) | ALDH1A1KDM4EMAPTTDP1GAA |
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 |
|---|---|---|---|---|---|---|---|
| JP-2006001887-A | 1,3,5-TRIS(3,5-DI-tert-BUTYL-4-HYDROXYBENZYL) THIOISOCYANURATE | SHIKOKU CHEM CORP | 2006-01-05 | — | — | JP | disclosed |