Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.54 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.54 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.54 |
| ▸ | F12 | P00748 | 5/20 | 0.47 |
| ▸ | KLK3 | P07288 | 3/20 | 0.47 |
| ▸ | EGFR | P00533 | 1/20 | 0.47 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.47 |
| ▸ | TUBB | P07437 | 1/20 | 0.47 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.47 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.47 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.47 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.47 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.47 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.47 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.47 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.47 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.47 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.47 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.47 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6871212 | 0.87 | ALDH1A1 (0.48) | ALDH1A1MAPTKMT2AKLK7KLK5 | |
| SCHEMBL6867215 | 0.80 | PLAU (0.47) | EGFRF2POLBKMT2ACYP1A2 | |
| SCHEMBL6869675 | 0.80 | ALDH1A1 (0.54) | F12KLK3ALDH1A1F2POLB | |
| SCHEMBL6867024 | 0.80 | F12 (0.41) | F12KLK3F2MAPTKMT2A | |
| SCHEMBL6867019 | 0.79 | DYRK1A (0.47) | F12ALDH1A1ABL1KDM4E | |
| SCHEMBL6867379 | 0.78 | ADORA2A (0.66) | F12KLK3F2KDM4E | |
| SCHEMBL6871806 | 0.78 | ADORA2A (0.42) | — | |
| SCHEMBL6872919 | 0.77 | KDM4A (0.52) | ALDH1A1POLBMAPTKMT2AHPGD | |
| SCHEMBL6871512 | 0.77 | KMT2A (0.49) | F12ALDH1A1F2MAPTKMT2A | |
| SCHEMBL6871681 | 0.76 | ADORA2A (0.51) | F12ALDH1A1F2MAPTKMT2A |
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-1347974-B1 | AMINOTRIAZOLOPYRIDIINE DERIVATIVES AS ADENOSINE RECEPTOR LIGANDS | HOFFMANN LA ROCHE (CH) | 2004-11-03 | — | — | EP | disclosed |