Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.55 |
| ▸ | MAOB | P27338 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | FPR2 | P25090 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | THRA | P10827 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL30417552 | 0.98 | ALDH1A1 (0.57) | ALDH1A1MAOBSMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL1984327 | 0.98 | ALDH1A1 (0.57) | ALDH1A1MAOBSMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL5255523 | 0.86 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2KDM4EHSD17B10MAPT | |
| SCHEMBL15853342 | 0.85 | MAOB (0.51) | ALDH1A1MAOBSMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL6668853 | 0.84 | MAOB (0.53) | ALDH1A1MAOBSMN1; SMN2KDM4EMAPT | |
| SCHEMBL8211971 | 0.84 | MAOB (0.53) | ALDH1A1MAOBSMN1; SMN2KDM4EMAPT | |
| SCHEMBL3677313 | 0.83 | KDM4E (0.52) | ALDH1A1MAOBSMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL9684741 | 0.83 | MAOB (0.43) | ALDH1A1MAOBSMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL5932752 | 0.82 | MAOB (0.51) | ALDH1A1MAOBSMN1; SMN2KDM4EMAPT | |
| SCHEMBL9190522 | 0.82 | MAOB (0.51) | ALDH1A1MAOBKDM4EMAPTADORA2A |
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 |