Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 5/20 | 0.39 |
| ▸ | HTR2C | P28335 | 5/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.35 |
| ▸ | TGFBR1 | P36897 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | XDH | P47989 | 1/20 | 0.32 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.32 |
| ▸ | EPHB3 | P54753 | 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 | |
|---|---|---|---|---|
| SCHEMBL129461 | 0.75 | HTR2A (0.43) | HTR2AHTR2CMAOB | |
| SCHEMBL124887 | 0.70 | HTR2C (0.44) | HTR2AHTR2C | |
| SCHEMBL125415 | 0.69 | MTNR1A (0.39) | HTR2AHTR2C | |
| SCHEMBL125392 | 0.69 | HTR2A (0.40) | HTR2AHTR2C | |
| SCHEMBL28801140 | 0.67 | EPHB3 (0.43) | HTR2AL3MBTL1KDM4ENR4A3MAPT | |
| SCHEMBL31150987 | 0.67 | L3MBTL1 (0.43) | L3MBTL1KEAP1NFE2L2NR4A3POLB | |
| SCHEMBL28630040 | 0.67 | L3MBTL1 (0.40) | L3MBTL1KEAP1NFE2L2TGFBR1KDM4E | |
| SCHEMBL1701947 | 0.67 | L3MBTL1 (0.40) | L3MBTL1KEAP1NFE2L2TGFBR1KDM4E | |
| SCHEMBL1702440 | 0.67 | L3MBTL1 (0.40) | L3MBTL1KEAP1NFE2L2TGFBR1KDM4E | |
| SCHEMBL15231477 | 0.66 | XDH (0.36) | L3MBTL1KDM4EPOLBMAPTMAOB |
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 |
|---|---|---|---|---|---|---|---|
| EP-2100895-B1 | TRICYCLIC COMPOUND AND MEDICAL USE THEREOF | TAKEDA PHARMACEUTICAL (JP) | 2012-03-07 | — | — | EP | disclosed |