Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18655571 | 0.75 | TDP1 (0.38) | ACHEALDH1A1 | |
| SCHEMBL7869641 | 0.74 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL3114728 | 0.72 | ALDH1A1 (0.50) | ACHEALDH1A1 | |
| SCHEMBL28947501 | 0.71 | NAAA (0.48) | ACHEALDH1A1NPSR1 | |
| SCHEMBL6882142 | 0.71 | ACHE (0.40) | ACHEALDH1A1 | |
| SCHEMBL6577987 | 0.70 | ACHE (0.61) | ACHEALDH1A1NOS3NOS1NOS2 | |
| SCHEMBL10515804 | 0.69 | NAAA (0.52) | ACHEALDH1A1NPSR1 | |
| SCHEMBL9153319 | 0.69 | NAAA (0.52) | ACHEALDH1A1NPSR1 | |
| SCHEMBL14566016 | 0.69 | NAAA (0.52) | ACHEALDH1A1NPSR1 | |
| SCHEMBL7067758 | 0.69 | ACHE (0.50) | ACHEALDH1A1NPSR1NOS3NOS1 |
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-6376548-B1 | FUNGICIDES; HERBICIDES; INSECTICIDES | ROHM AND HAAS COMPANY | 2002-04-23 | — | — | US | disclosed |
| WO-2001056358-A2 | ENHANCED PROPERTIED PESTICIDES | ROHM AND HAAS COMPANY (US) | 2001-08-09 | — | — | WO | disclosed |