Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 1/20 | 0.43 |
| ▸ | CCND1 | P24385 | 1/20 | 0.43 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | TNKS | O95271 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7652867 | 0.85 | ALDH1A1 (0.48) | HCAR1EGFRMAPTGAAALDH1A1 | |
| SCHEMBL7652937 | 0.80 | TNKS (0.47) | MAPTGAAALDH1A1HTTNPC1 | |
| SCHEMBL7652832 | 0.79 | RPA1 (0.51) | MAPTTP53GAAALDH1A1LMNA | |
| SCHEMBL7652506 | 0.77 | TNKS (0.50) | MAPTALDH1A1LMNAHTTMAPK1 | |
| SCHEMBL7654102 | 0.75 | ADORA2B (0.41) | HCAR1MAPTALDH1A1LMNATSHR | |
| SCHEMBL182013 | 0.75 | ALDH1A1 (0.50) | TP53ALDH1A1TSHRMAPK1NPC1 | |
| SCHEMBL7650664 | 0.74 | ADORA3 (0.44) | ALDH1A1LMNAHTTTSHRMAPK1 | |
| SCHEMBL7650490 | 0.74 | MAPK11 (0.40) | CDK4CCND1HCAR1ALDH1A1TNKS | |
| SCHEMBL7652334 | 0.74 | HCAR1 (0.39) | HCAR1NPC1RAB9APOLBTNKS | |
| SCHEMBL7654345 | 0.74 | GAA (0.40) | HCAR1MAPTGAAALDH1A1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6492407-B2 | NEUROPROTECTIVE ACTIVITY | BOEHRINGER IMGELHEIM PHARMA KG (DE) | 2002-12-10 | — | — | US | disclosed |