Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL667585 | 0.90 | TSHR (0.54) | KMT2ATSHRALDH1A1CYP3A4TDP1 | |
| SCHEMBL30682787 | 0.83 | TSHR (0.43) | KMT2ATSHRALDH1A1CYP3A4TDP1 | |
| SCHEMBL3295168 | 0.83 | TSHR (0.43) | KMT2ATSHRALDH1A1CYP3A4TDP1 | |
| SCHEMBL27832802 | 0.81 | MEN1 (0.53) | KMT2ATSHRALDH1A1CYP3A4TDP1 | |
| SCHEMBL5576910 | 0.81 | LMNA (0.46) | KMT2ATSHRALDH1A1CYP3A4TDP1 | |
| SCHEMBL20817271 | 0.79 | ALDH1A1 (0.45) | KMT2ATSHRALDH1A1CYP3A4TDP1 | |
| SCHEMBL6573663 | 0.79 | KMT2A (0.57) | KMT2ATSHRALDH1A1CYP3A4TDP1 | |
| SCHEMBL5792626 | 0.78 | TSHR (0.48) | KMT2ATSHRALDH1A1CYP3A4TDP1 | |
| SCHEMBL27802819 | 0.77 | POLB (0.42) | KMT2ATSHRALDH1A1CYP3A4TDP1 | |
| SCHEMBL3150549 | 0.76 | ALDH1A1 (0.74) | KMT2ATSHRALDH1A1CYP3A4TDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1016405-A2 | Arylating medicaments | Radopath Pharmaceuticals International Limited (GB) | 2000-07-05 | — | — | EP | claimed |
| EP-0700287-A1 | ARYLATING MEDICAMENTS | RADOPATH LIMITED (GB) | 1996-03-13 | — | — | EP | claimed |
| WO-1994027584-A2 | ARYLATING MEDICAMENTS | RADOPATH LIMITED (GB) | 1994-12-08 | — | — | WO | claimed |