Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 3/20 | 0.45 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.45 |
| ▸ | IDO1 | P14902 | 4/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CD38 | P28907 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL16941401 | 0.86 | CYP19A1 (0.45) | CYP19A1CYP11B1CYP11B2IDO1CYP3A4 | |
| SCHEMBL11569176 | 0.82 | IDO1 (0.44) | CYP19A1CYP11B1CYP11B2IDO1CYP3A4 | |
| SCHEMBL8335380 | 0.82 | IDO1 (0.47) | CYP19A1CYP11B1CYP11B2IDO1CYP3A4 | |
| SCHEMBL7970075 | 0.79 | IDO1 (0.66) | CYP19A1CYP11B1CYP11B2IDO1CYP3A4 | |
| SCHEMBL6200680 | 0.79 | LMNA (0.53) | CYP19A1CYP11B1CYP11B2IDO1CYP3A4 | |
| SCHEMBL11705217 | 0.79 | IDO1 (0.66) | CYP19A1CYP11B1CYP11B2IDO1CYP3A4 | |
| SCHEMBL2657862 | 0.79 | IDO1 (0.45) | CYP19A1CYP11B1CYP11B2IDO1CYP3A4 | |
| SCHEMBL1885632 | 0.79 | CYP3A4 (0.46) | CYP19A1CYP11B1CYP11B2IDO1CYP3A4 | |
| SCHEMBL16559778 | 0.77 | CYP2D6 (0.44) | CYP19A1CYP11B1CYP11B2IDO1CYP3A4 | |
| SCHEMBL11846584 | 0.77 | IDO1 (0.43) | CYP19A1CYP11B1CYP11B2IDO1CYP3A4 |
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-2002074773-A1 | IMIDAZO-PYRIMIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | MERCK SHARP & DOHME LIMITED (GB) | 2002-09-26 | — | — | WO | disclosed |