Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.44 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MPO | P05164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9736585 | 1.00 | KMT2A (0.46) | KMT2APLA2G1BATG4BALDH1A1LMNA | |
| SCHEMBL7165118 | 0.90 | ALDH1A1 (0.50) | KMT2AALDH1A1LMNAADRB2HTT | |
| SCHEMBL6936259 | 0.90 | ALDH1A1 (0.50) | KMT2AALDH1A1LMNAADRB2HTT | |
| SCHEMBL10654350 | 0.90 | ALDH1A1 (0.50) | KMT2AALDH1A1LMNAADRB2HTT | |
| SCHEMBL9736965 | 0.85 | KMT2A (0.45) | KMT2APLA2G1BATG4BALDH1A1LMNA | |
| SCHEMBL9736970 | 0.85 | KMT2A (0.45) | KMT2APLA2G1BATG4BALDH1A1LMNA | |
| SCHEMBL9894742 | 0.81 | KMT2A (0.45) | KMT2APLA2G1BATG4BALDH1A1 | |
| SCHEMBL9894740 | 0.81 | KMT2A (0.45) | KMT2APLA2G1BATG4BALDH1A1 | |
| SCHEMBL9894739 | 0.81 | KMT2A (0.45) | KMT2APLA2G1BATG4BALDH1A1 | |
| SCHEMBL9944266 | 0.80 | HPGD (0.41) | ALDH1A1LMNAHTTKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-5145954-A | Fungicides, insecticides, plant growth regualtors | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-09-08 | — | — | US | disclosed |
| EP-0244077-A1 | Sulphides derived from substituted phenyl-2-acrylic acid | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1987-11-04 | — | — | EP | disclosed |