Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S100A4 | P26447 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.40 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.38 |
| ▸ | PTPRC | P08575 | 1/20 | 0.38 |
| ▸ | DHFR | P00374 | 1/20 | 0.38 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.38 |
| ▸ | PTGES | O14684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | LCK | P06239 | 1/20 | 0.38 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.37 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.37 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9566403 | 0.83 | TSHR (0.51) | S100A4TDP1ALDH1A1PDE10APTPRC | |
| SCHEMBL9566567 | 0.79 | RAB9A (0.48) | KDM4E | |
| SCHEMBL9566483 | 0.73 | ALDH1A1 (0.52) | S100A4TDP1ALDH1A1KDM4EKMT2A | |
| SCHEMBL11901405 | 0.73 | S100A4 (0.50) | S100A4TDP1ALDH1A1KMT2AHPGD | |
| SCHEMBL20276535 | 0.73 | S100A4 (0.62) | S100A4TDP1ALDH1A1KDM4EKMT2A | |
| SCHEMBL213882 | 0.72 | TDP1 (0.50) | TDP1ALDH1A1KDM4EKMT2AMEN1 | |
| SCHEMBL9566530 | 0.72 | DHFR (0.60) | TDP1ALDH1A1KMT2AMEN1NCOA1 | |
| SCHEMBL30462497 | 0.71 | TDP1 (0.53) | S100A4TDP1ALDH1A1KMT2AMEN1 | |
| SCHEMBL18967848 | 0.71 | S100A4 (0.56) | S100A4TDP1ALDH1A1KDM4EKMT2A | |
| SCHEMBL2495684 | 0.71 | S100A4 (0.56) | S100A4TDP1ALDH1A1KDM4EKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0563386-A1 | ANTICANCER COMPOSITION AND COMPOUND | NIPPON SHINYAKU COMPANY, LIMITED (JP) | 1993-10-06 | — | — | EP | disclosed |