Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.54 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.54 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 6/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | CASR | P41180 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL7670066 | 0.79 | HPGD (0.52) | ALDH1A1KDM4EHPGDMAPTMEN1 | |
| SCHEMBL5009162 | 0.77 | KDM4E (0.77) | ALDH1A1KDM4ERCE1NLRP3HPGD | |
| SCHEMBL11415911 | 0.75 | LMNA (0.57) | ALDH1A1KDM4ERCE1MAPTPOLB | |
| SCHEMBL11835403 | 0.75 | ALDH1A1 (0.57) | ALDH1A1KDM4ERCE1HPGDMAPT | |
| SCHEMBL11225987 | 0.75 | ALDH1A1 (0.49) | ALDH1A1KDM4ERCE1HPGDMAPT | |
| SCHEMBL11858014 | 0.74 | ALDH1A1 (0.56) | ALDH1A1KDM4ERCE1HPGDMAPT | |
| SCHEMBL10027939 | 0.74 | AGTR1 (0.50) | ALDH1A1KDM4ERCE1HPGDMAPT | |
| SCHEMBL11077028 | 0.74 | NLRP3 (0.55) | ALDH1A1KDM4ENLRP3HPGDMAPT | |
| SCHEMBL116890 | 0.74 | ALDH1A1 (1.00) | ALDH1A1KDM4ERCE1HPGDMAPT | |
| Hydrochloric Acid SCHEMBL11454781 | 0.73 | DRD3 (0.53) | ALDH1A1MAPTMEN1KMT2ASMN1; SMN2 |
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-6479499-B1 | INHIBITORS OF TUBULIN POLYMERIZATION | NATIONAL SCIENCE COUNCIL (TW) | 2002-11-12 | — | — | US | disclosed |