Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BDKRB1 | P46663 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.31 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.30 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.30 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.30 |
| ▸ | GHSR | Q92847 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17849211 | 0.87 | L3MBTL1 (0.38) | BDKRB1SMN1; SMN2KDM4EALDH1A1MEN1 | |
| SCHEMBL17849200 | 0.86 | CYP2A13 (0.39) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL18052608 | 0.82 | MEN1 (0.31) | MEN1KMT2A | |
| SCHEMBL16623468 | 0.81 | MPO (0.31) | — | |
| SCHEMBL17849193 | 0.78 | F10 (0.43) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL17849192 | 0.77 | RIPK1 (0.37) | SMN1; SMN2KDM4EKMT2A | |
| SCHEMBL16623477 | 0.76 | BDKRB1 (0.36) | BDKRB1SMN1; SMN2KMT2A | |
| SCHEMBL16623544 | 0.76 | MEN1 (0.32) | MEN1KMT2A | |
| SCHEMBL17849208 | 0.76 | HDAC6 (0.33) | SMN1; SMN2ALDH1A1KMT2A | |
| SCHEMBL17849189 | 0.74 | RAB9A (0.45) | SMN1; SMN2KDM4EALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9371320-B2 | Heterocyclic compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2016-06-21 | — | — | US | disclosed |
| US-9371320-B2 | Heterocyclic compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2016-06-21 | — | — | US | disclosed |