Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | IDO1 | P14902 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.42 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.42 |
| ▸ | GRIA1 | P42261 | 2/20 | 0.42 |
| ▸ | GRIA2 | P42262 | 2/20 | 0.42 |
| ▸ | GRIA3 | P42263 | 2/20 | 0.42 |
| ▸ | GRIA4 | P48058 | 2/20 | 0.42 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.42 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.42 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.42 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.42 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL29074608 | 0.98 | MAOA (0.44) | MAOAMAOBIDO1CYP3A4MAPT | |
| Hydrochloric Acid SCHEMBL29190796 | 0.96 | CYP3A4 (0.48) | MAOAMAOBIDO1CYP3A4MAPT | |
| SCHEMBL22518744 | 0.82 | TSHR (0.44) | IDO1CYP3A4MAPTTSHRTHRB | |
| SCHEMBL20787990 | 0.81 | TACR1 (0.45) | MAOAMAOBIDO1CYP3A4MAPT | |
| Bromide SCHEMBL18131579 | 0.80 | TSHR (0.43) | IDO1CYP3A4MAPTTSHRTHRB | |
| SCHEMBL23740296 | 0.79 | P2RX7 (0.41) | CYP3A4MAPTTSHR | |
| SCHEMBL20198672 | 0.79 | P2RX7 (0.41) | CYP3A4MAPTTSHR | |
| SCHEMBL15824244 | 0.79 | DPP4 (0.43) | IDO1CYP3A4MAPTTSHRGRIN2D | |
| SCHEMBL3134950 | 0.78 | IDO1 (0.43) | IDO1TSHRTHRB | |
| SCHEMBL27893441 | 0.78 | KDM4E (0.42) | IDO1CYP3A4MAPTTSHRTHRB |
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 |
|---|---|---|---|---|---|---|---|
| CN-109180607-B | Method for synthesizing thiazine diketone heterocyclic compound by catalyzing carbonyl sulfide conversion with organic catalyst | 大连理工大学 | 2021-04-16 | — | — | CN | disclosed |