Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.54 |
| ▸ | MAOB | P27338 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | ERN1 | O75460 | 3/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5389654 | 0.88 | NTRK1 (0.55) | CYP1A1CYP1A2CYP1B1MAOBALDH1A1 | |
| SCHEMBL8678236 | 0.81 | MAOA (0.58) | CYP1A1CYP1A2CYP1B1MAOBALDH1A1 | |
| SCHEMBL3091522 | 0.80 | ALDH1A1 (0.52) | CYP1A1CYP1A2CYP1B1MAOBALDH1A1 | |
| SCHEMBL18274905 | 0.78 | CHRM2 (0.50) | CYP1A1CYP1A2CYP1B1MAOBALDH1A1 | |
| SCHEMBL5124787 | 0.77 | GPR35 (0.56) | CYP1A1CYP1A2CYP1B1MAOBALDH1A1 | |
| SCHEMBL3905767 | 0.76 | ALDH1A1 (0.48) | CYP1A1CYP1A2CYP1B1MAOBALDH1A1 | |
| SCHEMBL29214175 | 0.75 | MAOB (0.62) | CYP1A1CYP1A2CYP1B1MAOBALDH1A1 | |
| SCHEMBL30861756 | 0.75 | MAOB (0.62) | CYP1A1CYP1A2CYP1B1MAOBALDH1A1 | |
| SCHEMBL30485740 | 0.74 | MAOB (0.61) | CYP1A1CYP1A2CYP1B1MAOBALDH1A1 | |
| SCHEMBL11725678 | 0.74 | MAOB (0.61) | CYP1A1CYP1A2CYP1B1MAOBALDH1A1 |
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-5182295-A | Miticides, fungicides | ROUSSEL UCLAF (FR) | 1993-01-26 | — | — | US | disclosed |