Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KA3 | P51812 | 3/20 | 0.47 |
| ▸ | CHEK1 | O14757 | 5/20 | 0.45 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.42 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.42 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.41 |
| ▸ | CDK1 | P06493 | 2/20 | 0.41 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.41 |
| ▸ | GSK3A | P49840 | 2/20 | 0.41 |
| ▸ | GSK3B | P49841 | 2/20 | 0.41 |
| ▸ | CCNB3 | Q8WWL7 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL17279842 | 0.81 | HPGD (0.45) | KDM4EALDH1A1HPGDHSD17B10NPC1 | |
| SCHEMBL5216372 | 0.81 | CDK4 (0.50) | KDM4EALDH1A1HPGDHSD17B10SMN1; SMN2 | |
| SCHEMBL5218883 | 0.78 | PDPK1 (0.45) | RPS6KA3CHEK1ALKDYRK1ADYRK1B | |
| SCHEMBL8887295 | 0.77 | LMNA (0.54) | KDM4EALDH1A1HPGDHSD17B10NPC1 | |
| SCHEMBL8011429 | 0.74 | RPS6KA3 (0.69) | RPS6KA3CHEK1ALKKDM4EALDH1A1 | |
| SCHEMBL19923002 | 0.71 | ALDH1A1 (0.51) | KDM4EALDH1A1HPGDHSD17B10NPC1 | |
| SCHEMBL28319223 | 0.71 | PDE4A (0.50) | CHEK1NPC1RAB9AKMT2AMEN1 | |
| SCHEMBL17296040 | 0.71 | PARP1 (0.43) | RPS6KA3ALKKDM4EALDH1A1HPGD | |
| SCHEMBL7820094 | 0.71 | CHEK1 (0.49) | RPS6KA3CHEK1 | |
| SCHEMBL12567890 | 0.70 | ALDH1A1 (0.55) | KDM4EALDH1A1HPGDHSD17B10NPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2000019994-A9 | ESTROGEN RECEPTOR LIGANDS | UNIV ILLINOIS (US) | 2000-08-31 | — | — | WO | disclosed |
| WO-2000019994-A1 | ESTROGEN RECEPTOR LIGANDS | BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) | 2000-04-13 | — | — | WO | disclosed |