Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 3/20 | 0.32 |
| ▸ | NOS1 | P29475 | 3/20 | 0.32 |
| ▸ | NOS2 | P35228 | 3/20 | 0.32 |
| ▸ | FYN | P06241 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL7992355 | 0.94 | CYP1A2 (0.37) | CYP1A2CA1CA2CA4FYN | |
| SCHEMBL18757630 | 0.88 | CYP1A2 (0.57) | CYP1A2NOS1NOS2 | |
| SCHEMBL7994419 | 0.88 | CYP1A2 (0.57) | CYP1A2NOS1NOS2 | |
| SCHEMBL21386448 | 0.87 | CYP1A2 (0.34) | CYP1A2NOS3NOS1NOS2 | |
| SCHEMBL11783981 | 0.85 | CYP1A2 (0.53) | CYP1A2 | |
| SCHEMBL11783986 | 0.85 | CYP1A2 (0.53) | CYP1A2 | |
| SCHEMBL1525531 | 0.85 | — | — | |
| SCHEMBL9658057 | 0.83 | CYP1A2 (0.33) | CYP1A2KDM4E | |
| SCHEMBL7980378 | 0.83 | CYP1A2 (0.33) | CYP1A2KDM4E | |
| SCHEMBL7994840 | 0.82 | CYP1A2 (0.54) | CYP1A2NOS1NOS2 |
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-6277790-B1 | APPLYING PLANTS, SEEDS, SOILS OR ENVIRONMENT | BASF AKTIENGESELLSCHAFT (DE) | 2001-08-21 | — | — | US | disclosed |