Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | CDK2 | P24941 | 1/20 | 0.43 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.42 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.42 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.42 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.42 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.42 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.42 |
| ▸ | DCTPP1 | Q9H773 | 2/20 | 0.42 |
| ▸ | VCAM1 | P19320 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL4069830 | 0.86 | ALDH1A1 (0.51) | TSHRALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL30752461 | 0.86 | TSHR (0.55) | TSHRALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL29185998 | 0.86 | TSHR (0.55) | TSHRALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL9745170 | 0.82 | ALDH1A1 (0.48) | TSHRALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL28740310 | 0.82 | CDK2 (0.48) | TSHRALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL3639673 | 0.79 | TSHR (0.50) | TSHRALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL29186007 | 0.79 | ALDH1A1 (0.55) | TSHRALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL11030713 | 0.79 | ALDH1A1 (0.55) | TSHRALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL1952775 | 0.78 | ALDH1A1 (0.64) | TSHRALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL10558557 | 0.78 | TSHR (0.64) | TSHRALDH1A1CYP1A2CYP2D6CYP2C19 |
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 4 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 |
| CN-1124012-A | Arylating medicaments | RADOPATH LTD (GB) | 1996-06-05 | — | — | CN | 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 |