Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.51 |
| ▸ | AKR1C3 | P42330 | 4/20 | 0.50 |
| ▸ | AKR1C2 | P52895 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.47 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.47 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.46 |
| ▸ | TUBB | P07437 | 1/20 | 0.46 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.46 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.46 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.46 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.46 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.46 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.46 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6434542 | 0.93 | MEN1 (0.54) | SLC6A4AKR1C3AKR1C2MEN1KMT2A | |
| SCHEMBL31120368 | 0.87 | TP53 (0.62) | TP53AKR1C3AKR1C2ALDH1A1CSNK2A1 | |
| SCHEMBL6432585 | 0.83 | SLC6A4 (0.56) | SLC6A4AKR1C3AKR1C2MEN1KMT2A | |
| SCHEMBL29441710 | 0.83 | SLC6A4 (0.56) | SLC6A4AKR1C3AKR1C2MEN1KMT2A | |
| SCHEMBL15229768 | 0.82 | MYC (0.55) | TP53SLC6A4MEN1KMT2AALDH1A1 | |
| SCHEMBL1569116 | 0.81 | EGFR (0.57) | TP53SLC6A4MEN1KMT2AALDH1A1 | |
| SCHEMBL27086380 | 0.81 | SLC6A4 (0.49) | SLC6A4AKR1C3AKR1C2MEN1KMT2A | |
| SCHEMBL6852757 | 0.80 | TP53 (0.64) | TP53AKR1C3AKR1C2CSNK2A1KEAP1 | |
| SCHEMBL6434824 | 0.80 | MAPT (0.49) | TP53SLC6A4MEN1KMT2AALDH1A1 | |
| SCHEMBL22336247 | 0.79 | KDM4E (0.53) | SLC6A4AKR1C3AKR1C2MEN1KMT2A |
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-1087943-B1 | THERAPEUTIC BIARYL DERIVATIVES | GLAXO GROUP LTD (GB) | 2005-08-17 | — | — | EP | disclosed |
| US-6251925-B1 | AN AGONISTS FOR HUMAN BETA-3 ADRENOCEPTOR | GLAXO WELLCOME INC. | 2001-06-26 | — | — | US | disclosed |
| EP-1087943-A1 | THERAPEUTIC BIARYL DERIVATIVES | GLAXO GROUP LIMITED (GB) | 2001-04-04 | — | — | EP | disclosed |
| WO-1999065877-A1 | THERAPEUTIC BIARYL DERIVATIVES | GLAXO GROUP LIMITED (GB) | 1999-12-23 | — | — | WO | disclosed |