Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | HTR1A | P08908 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | HTR2C | P28335 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | BACE1 | P56817 | 2/20 | 0.48 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | TUBB1 | Q9H4B7 | 5/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | TUBB4A | P04350 | 3/20 | 0.44 |
| ▸ | TUBB | P07437 | 3/20 | 0.44 |
| ▸ | TUBA3C | P0DPH7 | 3/20 | 0.44 |
| ▸ | TUBA1B | P68363 | 3/20 | 0.44 |
| ▸ | TUBA4A | P68366 | 3/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5669687 | 1.00 | ALDH1A1 (0.49) | ALDH1A1GAAHTTKDM4EHTR1A | |
| SCHEMBL5669065 | 0.92 | ALDH1A1 (0.57) | ALDH1A1GAAHTTKDM4EHTR1A | |
| SCHEMBL5669062 | 0.92 | ALDH1A1 (0.57) | ALDH1A1GAAHTTKDM4EHTR1A | |
| SCHEMBL5668055 | 0.87 | CYP1A2 (0.59) | ALDH1A1GAAKDM4EHPGDLMNA | |
| SCHEMBL5668058 | 0.87 | CYP1A2 (0.59) | ALDH1A1GAAKDM4EHPGDLMNA | |
| SCHEMBL6686272 | 0.82 | CYP1A2 (0.50) | ALDH1A1GAAHTTKDM4ELMNA | |
| SCHEMBL6686274 | 0.82 | CYP1A2 (0.50) | ALDH1A1GAAHTTKDM4ELMNA | |
| SCHEMBL7060721 | 0.81 | TNFRSF1A (0.49) | ALDH1A1GAAHTTKDM4EHTR1A | |
| SCHEMBL7060718 | 0.81 | TNFRSF1A (0.49) | ALDH1A1GAAHTTKDM4EHTR1A | |
| SCHEMBL5667595 | 0.80 | ALDH1A1 (0.59) | ALDH1A1GAAHTTKDM4EHTR1A |
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-1551418-A4 | SUBSTITUTED KETOPHOSPHONATE COMPOUNDS HAVING BONE ANABOLIC ACTIVITY | ILEX ONCOLOGY RES SARL (CH) | 2006-05-03 | — | — | EP | claimed |
| JP-2006504697-A | — | — | 2006-02-09 | — | — | JP | claimed |
| EP-1551418-A1 | SUBSTITUTED KETOPHOSPHONATE COMPOUNDS HAVING BONE ANABOLIC ACTIVITY | Ilex Oncology Research Sàrl (CH) | 2005-07-13 | — | — | EP | claimed |
| WO-2004026315-A1 | SUBSTITUTED KETOPHOSPHONATE COMPOUNDS HAVING BONE ANABOLIC ACTIVITY | ILEX ONCOLOGY RESEARCH, SARL (CH) | 2004-04-01 | — | — | WO | claimed |