Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 7/20 | 0.56 |
| ▸ | CES1 | P23141 | 7/20 | 0.56 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.41 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.41 |
| ▸ | SMO | Q99835 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9869117 | 0.79 | CES2 (0.56) | CES2CES1NR4A1CYP19A1ALDH1A1 | |
| SCHEMBL31478156 | 0.77 | CES2 (0.68) | CES2CES1NR4A1CYP19A1ALDH1A1 | |
| SCHEMBL2156437 | 0.77 | CES2 (0.72) | CES2CES1NR4A1ALDH1A1HPGD | |
| SCHEMBL10808749 | 0.77 | CES2 (0.72) | CES2CES1NR4A1ALDH1A1HPGD | |
| SCHEMBL30383014 | 0.76 | CES2 (0.53) | CES2CES1ALDH1A1LMNAMAPT | |
| SCHEMBL30832106 | 0.74 | CES2 (0.60) | CES2CES1ALDH1A1LMNAMAPT | |
| SCHEMBL912515 | 0.74 | CES2 (1.00) | CES2CES1NR4A1MAPTRAB9A | |
| SCHEMBL2156440 | 0.73 | CES2 (0.67) | CES2CES1NR4A1ALDH1A1HPGD | |
| SCHEMBL2225523 | 0.73 | CES2 (0.78) | CES2CES1ALDH1A1HPGDRAB9A | |
| SCHEMBL3138767 | 0.73 | CES2 (0.54) | CES2CES1NR4A1ALDH1A1LMNA |
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-5017595-A | Azolylmethylallyl alcohols and fungicides containing these compounds | BASF AKTIENGESELLSCHAFT (DE) | 1991-05-21 | — | — | US | disclosed |