Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 10/20 | 0.69 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.65 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.62 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.62 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL23019750 | 1.00 | GRIN2B (0.69) | GRIN2BTAAR1SIGMAR1GRIN1EPHX1 | |
| SCHEMBL23599404 | 1.00 | GRIN2B (0.69) | GRIN2BTAAR1SIGMAR1GRIN1EPHX1 | |
| SCHEMBL27929338 | 0.93 | GRIN2B (0.71) | GRIN2BTAAR1SIGMAR1GRIN1EPHX1 | |
| Hydrochloric Acid SCHEMBL9396249 | 0.92 | GRIN2B (0.69) | GRIN2BTAAR1SIGMAR1GRIN1EPHX1 | |
| SCHEMBL25006485 | 0.91 | GRIN2B (0.76) | GRIN2BSIGMAR1GRIN1 | |
| SCHEMBL25006478 | 0.90 | GRIN2B (0.78) | GRIN2BSIGMAR1GRIN1 | |
| SCHEMBL24767088 | 0.86 | TAAR1 (0.84) | GRIN2BTAAR1SIGMAR1GRIN1EPHX1 | |
| SCHEMBL22216853 | 0.86 | TAAR1 (0.84) | GRIN2BTAAR1SIGMAR1GRIN1EPHX1 | |
| SCHEMBL21792273 | 0.86 | TAAR1 (0.84) | GRIN2BTAAR1SIGMAR1GRIN1EPHX1 | |
| SCHEMBL25002632 | 0.86 | TAAR1 (0.84) | GRIN2BTAAR1SIGMAR1GRIN1EPHX1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019149244-A1 | JAK INHIBITOR AND USE THEREOF | 南京明德新药研发股份有限公司 | 2019-08-08 | — | — | WO | disclosed |