Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.36 |
| ▸ | FPR2 | P25090 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1984327 | 0.84 | ALDH1A1 (0.57) | MAOBALDH1A1SMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL30417552 | 0.84 | ALDH1A1 (0.57) | MAOBALDH1A1SMN1; SMN2KDM4EHSD17B10 | |
| O-Xylene SCHEMBL9685099 | 0.83 | ALDH1A1 (0.55) | MAOBALDH1A1SMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL9685864 | 0.79 | ALDH1A1 (0.47) | MAOBALDH1A1SMN1; SMN2KDM4ELMNA | |
| SCHEMBL3206497 | 0.76 | ESR1 (0.56) | ALDH1A1LMNACYP3A4 | |
| SCHEMBL5255523 | 0.74 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2KDM4EHSD17B10LMNA | |
| SCHEMBL8214225 | 0.74 | FABP4 (0.50) | ALDH1A1SMN1; SMN2KDM4EHSD17B10LMNA | |
| SCHEMBL10583241 | 0.73 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2KDM4EHSD17B10MAPT | |
| SCHEMBL15853342 | 0.73 | MAOB (0.51) | MAOBALDH1A1SMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL4231829 | 0.73 | ALDH1A1 (0.52) | MAOBALDH1A1KDM4ELMNAMAPT |
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-5078838-A | By electrochemical anodic oxidation of benzyl derivatives in the presence of an aliphatic alcohol | BASF AKTIENGESELLSCHAFT (DE) | 1992-01-07 | — | — | US | disclosed |