Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.43 |
| ▸ | FABP4 | P15090 | 2/20 | 0.43 |
| ▸ | SSTR4 | P31391 | 7/20 | 0.42 |
| ▸ | GSK3A | P49840 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.37 |
| ▸ | KDM1A | O60341 | 1/20 | 0.37 |
| ▸ | SLC13A5 | Q86YT5 | 1/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.37 |
| ▸ | GAPDH | P04406 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | PTPRC | P08575 | 1/20 | 0.36 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.36 |
| ▸ | SSTR1 | P30872 | 1/20 | 0.36 |
| ▸ | SSTR2 | P30874 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL3276482 | 0.85 | SSTR4 (0.43) | SSTR4KDM1AS1PR1SSTR1SSTR2 | |
| Trifluoroacetic Acid SCHEMBL3283658 | 0.84 | SSTR4 (0.53) | SSTR4S1PR1SSTR1SSTR2SSTR3 | |
| Trifluoroacetic Acid SCHEMBL3276216 | 0.83 | SSTR4 (0.44) | SSTR4S1PR1SSTR1SSTR2SSTR3 | |
| Trifluoroacetic Acid SCHEMBL3283657 | 0.81 | SSTR4 (0.41) | SSTR4SLC22A12S1PR1SSTR1SSTR2 | |
| Trifluoroacetic Acid SCHEMBL3281724 | 0.81 | CHEK2 (0.42) | SSTR4S1PR1SSTR1SSTR2SSTR3 | |
| Trifluoroacetic Acid SCHEMBL3276723 | 0.80 | SSTR4 (0.42) | SSTR4S1PR1SSTR1SSTR2SSTR3 | |
| Trifluoroacetic Acid SCHEMBL3275406 | 0.80 | SSTR4 (0.41) | SSTR4S1PR1 | |
| Trifluoroacetic Acid SCHEMBL3281053 | 0.80 | DRD2 (0.43) | SSTR4KDM1AS1PR1 | |
| Trifluoroacetic Acid SCHEMBL3281299 | 0.79 | SSTR4 (0.40) | SSTR4AKR1C3AKR1C2KDM1AS1PR1 | |
| Trifluoroacetic Acid SCHEMBL3278005 | 0.79 | SSTR4 (0.42) | SSTR4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2123644-B1 | BENZOXAZEPINE DERIVATIVES AND USE THEREOF | TAKEDA PHARMACEUTICAL (JP) | 2014-12-17 | — | — | EP | disclosed |
| EP-2123644-A1 | BENZOXAZEPINE DERIVATIVES AND USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2009-11-25 | — | — | EP | disclosed |