Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 4/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 4/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.37 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.37 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1735 | 0.92 | — | — | |
| SCHEMBL29669690 | 0.92 | — | — | |
| Benzene SCHEMBL28328872 | 0.90 | ACHE (0.58) | ACHEALDH1A1MAPK1TP53TDP1 | |
| Bromide SCHEMBL3348646 | 0.90 | — | — | |
| Fluoride SCHEMBL3562136 | 0.90 | ACHE (0.58) | ACHEALDH1A1MAPK1IDO1TP53 | |
| Cyanide SCHEMBL28115714 | 0.85 | ACHE (0.52) | ACHEALDH1A1MAPK1TP53TDP1 | |
| SCHEMBL12428854 | 0.84 | ACHE (0.53) | ACHEALDH1A1MAPK1TP53TDP1 | |
| M-Xylene SCHEMBL27490026 | 0.81 | ACHE (0.80) | ACHEALDH1A1MAPK1IDO1RELA | |
| SCHEMBL17750893 | 0.78 | ACHE (0.50) | ACHEALDH1A1MAPK1IDO1NPC1 | |
| SCHEMBL21730831 | 0.76 | ACHE (0.48) | ACHEALDH1A1MAPK1IDO1NPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100355710-C | Method for preparing aryl iodo substance | UNIV SHANGHAI JIAOTONG (CN) | 2007-12-19 | — | — | CN | disclosed |
| CN-1775716-A | Method for preparing aryl iodo substance | UNIV SHANGHAI JIAOTONG (CN) | 2006-05-24 | — | — | CN | disclosed |