Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 5/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | FBP1 | P09467 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 6/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.33 |
| ▸ | CCR3 | P51677 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4069804 | 0.78 | MAOA (0.40) | CYP17A1MAOAMAOBFBP1CYP19A1 | |
| SCHEMBL27709365 | 0.74 | CCR3 (0.36) | CYP17A1MAOAMAOBFBP1CYP19A1 | |
| SCHEMBL27847380 | 0.68 | IDO1 (0.40) | CYP17A1FBP1CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL27828854 | 0.68 | CYP3A4 (0.41) | CYP17A1FBP1CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL2049363 | 0.64 | IDO1 (0.51) | CYP17A1MAOAMAOBCYP19A1CYP11B1 | |
| SCHEMBL6447916 | 0.62 | IDO1 (0.57) | FBP1MEN1KMT2AALDH1A1LMNA | |
| SCHEMBL7186898 | 0.62 | IDO1 (0.53) | FBP1CYP19A1CYP11B1CYP11B2MEN1 | |
| SCHEMBL10592832 | 0.62 | IDO1 (0.57) | FBP1CYP19A1CYP11B1CYP11B2MEN1 | |
| SCHEMBL5800340 | 0.59 | CYP19A1 (0.74) | MAOAMAOBCYP19A1CYP11B1CYP11B2 | |
| SCHEMBL16382293 | 0.58 | IDO1 (0.73) | CYP19A1CYP11B1CYP11B2MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-101068776-A | As 5HT2AArylsulfonyl naphthalene derivatives as antagonists | MERCH SHARP & DOHME LTD (GB) | 2007-11-07 | — | — | CN | disclosed |