Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 8/20 | 0.44 |
| ▸ | IDO1 | P14902 | 6/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.44 |
| ▸ | TBXAS1 | P24557 | 5/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 4/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.44 |
| ▸ | TACR2 | P21452 | 4/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.44 |
| ▸ | HTR2A | P28223 | 4/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.44 |
| ▸ | DRD3 | P35462 | 4/20 | 0.44 |
| ▸ | OPRD1 | P41143 | 4/20 | 0.44 |
| ▸ | HTR2B | P41595 | 4/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11640908 | 0.86 | CYP2C9 (0.50) | CYP2C9IDO1CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL11641044 | 0.85 | CYP2A6 (0.50) | CYP3A4TBXAS1LMNACYP19A1 | |
| SCHEMBL11643655 | 0.85 | IDO1 (0.47) | CYP2C9IDO1CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL11643196 | 0.81 | LMNA (0.48) | CYP3A4TBXAS1LMNACYP19A1 | |
| SCHEMBL11642330 | 0.81 | CYP2C9 (0.47) | CYP2C9IDO1CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL11640239 | 0.81 | OGG1 (0.49) | CYP2C9IDO1CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL11643409 | 0.80 | FNTA (0.46) | CYP2C9IDO1CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL11646605 | 0.80 | CYP11B1 (0.47) | CYP3A4TBXAS1LMNACYP19A1CYP17A1 | |
| SCHEMBL11646616 | 0.80 | CYP19A1 (0.47) | TBXAS1LMNACYP19A1 | |
| SCHEMBL11642678 | 0.79 | IDO1 (0.51) | CYP2C9IDO1CYP3A4CYP2D6CYP2C19 |
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-4123542-A | FUNGICIDES, BACTERICIDES, ANTIPROTOZOAL AGENTS | SYNTEX (U.S.A.) INC. (US) | 1978-10-31 | — | — | US | disclosed |