Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.50 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.50 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.50 |
| ▸ | QPCT | Q16769 | 1/20 | 0.47 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | MIF | P14174 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | ABL1 | P00519 | 1/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | BCR | P11274 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8445012 | 0.82 | NPC1 (0.57) | METAP2MEN1KMT2ATSHRHTT | |
| SCHEMBL13870208 | 0.77 | HPGD (0.50) | CYP1A2CYP3A4CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL5376203 | 0.73 | HSD17B10 (0.58) | CYP1A2CYP3A4MAPTABL1METAP2 | |
| SCHEMBL14050074 | 0.71 | CDC7 (0.53) | KDM4EALDH1A1TSHRRAB9ACDC7 | |
| SCHEMBL13750190 | 0.71 | MAPK1 (0.44) | CYP2C19ALDH1A1MEN1KMT2ATSHR | |
| SCHEMBL4090500 | 0.70 | ABL1 (0.59) | CYP1A2CYP3A4CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL11265166 | 0.69 | ABL1 (0.58) | CYP1A2CYP3A4CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL1521163 | 0.69 | ABL1 (0.58) | KDM4EDRD2DRD4DRD3ABL1 | |
| SCHEMBL6477170 | 0.69 | ABL1 (0.58) | CYP1A2CYP3A4CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL3720497 | 0.69 | ABL1 (0.58) | DRD2DRD4DRD3ABL1ABCB1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005044008-A2 | 2 -AMINOTHIOPHENE COMPOUNDS AS FUNGICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2005-05-19 | — | — | WO | disclosed |