Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADCY8 | P40145 | 1/20 | 0.36 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 2/20 | 0.35 |
| ▸ | MAOB | P27338 | 2/20 | 0.35 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | NQO2 | P16083 | 3/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL7952131 | 1.00 | ADCY8 (0.36) | ADCY8ADCY1CES2MAOAMAOB | |
| SCHEMBL7943769 | 0.85 | CYP19A1 (0.47) | MAOAMAOBCYP19A1CYP11B2LMNA | |
| SCHEMBL7943767 | 0.85 | CYP19A1 (0.47) | MAOAMAOBCYP19A1CYP11B2LMNA | |
| SCHEMBL7951341 | 0.82 | CYP19A1 (0.47) | MAOBCYP19A1CYP11B2LMNAALDH1A1 | |
| SCHEMBL1688133 | 0.82 | CYP19A1 (0.47) | MAOBCYP19A1CYP11B2LMNAALDH1A1 | |
| SCHEMBL7951337 | 0.82 | CYP19A1 (0.47) | MAOBCYP19A1CYP11B2LMNAALDH1A1 | |
| SCHEMBL7943558 | 0.78 | NQO2 (0.39) | ADCY8ADCY1CES2MAOAMAOB | |
| SCHEMBL7943559 | 0.78 | NQO2 (0.39) | ADCY8ADCY1CES2MAOAMAOB | |
| SCHEMBL4688774 | 0.76 | CYP19A1 (0.56) | MAOAMAOBCYP19A1CYP11B2LMNA | |
| SCHEMBL4688568 | 0.76 | CYP19A1 (0.56) | MAOAMAOBCYP19A1CYP11B2LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6235789-B1 | GLANDULAR DISORDERS; SLEEP DISORDERS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-05-22 | — | — | US | disclosed |
| EP-0781271-A1 | BENZOCYCLOALKENE COMPOUNDS, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1997-07-02 | — | — | EP | disclosed |
| WO-1996008466-A1 | BENZOCYCLOALKENE COMPOUNDS, THEIR PRODUCTION AND USE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-03-21 | — | — | WO | disclosed |