Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | F3 | P13726 | 1/20 | 0.38 |
| ▸ | AKT1 | P31749 | 2/20 | 0.37 |
| ▸ | AKT2 | P31751 | 2/20 | 0.37 |
| ▸ | AKT3 | Q9Y243 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 4/20 | 0.36 |
| ▸ | MAOB | P27338 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | MIF | P14174 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11279958 | 1.00 | CYP1A2 (0.40) | CYP1A2F3AKT1AKT2AKT3 | |
| SCHEMBL11127494 | 0.76 | CYP1A2 (0.44) | CYP1A2F3AKT1AKT2AKT3 | |
| SCHEMBL11127493 | 0.76 | CYP1A2 (0.44) | CYP1A2F3AKT1AKT2AKT3 | |
| SCHEMBL11124329 | 0.75 | HPGD (0.35) | CYP1A2F3AKT1AKT2AKT3 | |
| SCHEMBL11290327 | 0.75 | HPGD (0.35) | CYP1A2F3AKT1AKT2AKT3 | |
| SCHEMBL11282100 | 0.72 | — | — | |
| SCHEMBL11126099 | 0.70 | CYP1A2 (0.44) | CYP1A2F3AKT1AKT2AKT3 | |
| SCHEMBL8954049 | 0.69 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL585569 | 0.69 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL11278495 | 0.64 | — | — |
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-4356187-A | INSECTICIDES | ROUSSEL UCLAF (FR) | 1982-10-26 | — | — | US | disclosed |