Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 2/20 | 0.33 |
| ▸ | DRD4 | P21917 | 2/20 | 0.33 |
| ▸ | DRD3 | P35462 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11064974 | 0.82 | KCNA3 (0.34) | TSHRALDH1A1TP53 | |
| SCHEMBL25212515 | 0.70 | ACHE (0.41) | CYP3A4TSHRACHEDRD2DRD4 | |
| SCHEMBL1726956 | 0.70 | ALDH1A1 (0.53) | ALDH1A1TP53 | |
| SCHEMBL5825048 | 0.69 | DRD2 (0.55) | DRD2DRD4DRD3L3MBTL1 | |
| Bromide SCHEMBL25222030 | 0.68 | ACHE (0.39) | CYP3A4TSHRACHEDRD2DRD4 | |
| Hydrochloric Acid SCHEMBL25265433 | 0.68 | ACHE (0.39) | CYP3A4TSHRACHEDRD2DRD4 | |
| Hydrochloric Acid SCHEMBL25265550 | 0.67 | ACHE (0.42) | CYP3A4TSHRACHEDRD2DRD4 | |
| Bromide SCHEMBL25197194 | 0.67 | ACHE (0.42) | CYP3A4TSHRACHEDRD2DRD4 | |
| SCHEMBL11659528 | 0.67 | ACHE (0.38) | CYP3A4TSHRACHEDRD2DRD4 | |
| SCHEMBL25198215 | 0.67 | ACHE (0.38) | CYP3A4TSHRACHEDRD2DRD4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4446061-A | FIREPROOFING, SMOKELESS, PHOSPHITE/PHOSPHONATE | MONSANTO COMPANY (US) | 1984-05-01 | — | — | US | disclosed |
| US-4260542-A | FLAME RETARDANTS, SMOKE SUPPRESSANTS | MONSANTO COMPANY (US) | 1981-04-07 | — | — | US | disclosed |
| US-4206133-A | FLAME RETARDANTS AND SMOKE SUPPRESSANTS | MONSANTO COMPANY (US) | 1980-06-03 | — | — | US | disclosed |
| US-4133823-A | FIREPROOFING, SMOKELESS | MONSANTO COMPANY (US) | 1979-01-09 | — | — | US | disclosed |