Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | UNG | P13051 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4430780 | 0.79 | MAPT (0.55) | MAPTMAPK1SMN1; SMN2KDM4EL3MBTL1 | |
| SCHEMBL10520475 | 0.78 | MAPT (0.58) | CYP1A2CYP2D6CYP2C9CYP2C19MAPT | |
| SCHEMBL1372198 | 0.75 | ADRA2A (0.46) | CYP3A4CYP2D6CYP2C9MAPTMAPK1 | |
| SCHEMBL1491116 | 0.73 | HAO1 (0.46) | CYP3A4CYP2C9MAPTSMN1; SMN2NPC1 | |
| SCHEMBL11593953 | 0.72 | MAPT (0.56) | MAPTTSHRMAPK1SMN1; SMN2KDM4E | |
| SCHEMBL14402936 | 0.72 | MAPT (0.56) | MAPTTSHRMAPK1L3MBTL1NPC1 | |
| SCHEMBL11514481 | 0.71 | MEN1 (0.50) | CYP1A2CYP2D6CYP2C9CYP2C19MAPT | |
| SCHEMBL49791 | 0.70 | NPC1 (0.58) | CYP3A4CYP2D6MAPTUNGMAPK1 | |
| SCHEMBL31151862 | 0.70 | NPC1 (0.58) | CYP3A4CYP2D6MAPTUNGMAPK1 | |
| SCHEMBL3525964 | 0.70 | PKM (0.50) | MAPTTSHRMAPK1SMN1; SMN2L3MBTL1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103788097-B | Fused ring compound and its purposes | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2016-03-30 | — | — | CN | disclosed |
| CN-102369205-B | fused ring compound and use thereof | TAKEDA PHARMACEUTICAL CO.,LTD. (JP) | 2014-10-29 | — | — | CN | disclosed |
| CN-103788097-A | Fused ring compound and application thereof | TAKEDA PHARMACEUTICAL | 2014-05-14 | — | — | CN | disclosed |
| CN-102369205-A | Fused ring compound and use thereof | TAKEDA PHARMACEUTICAL | 2012-03-07 | — | — | CN | disclosed |