Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 2/20 | 0.57 |
| ▸ | EED | O75530 | 2/20 | 0.56 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.55 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.53 |
| ▸ | HTR3B | O95264 | 1/20 | 0.53 |
| ▸ | HTR5A | P47898 | 1/20 | 0.53 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.53 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.53 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | GRIN2D | O15399 | 7/20 | 0.50 |
| ▸ | GRIN3B | O60391 | 7/20 | 0.50 |
| ▸ | GRIN1 | Q05586 | 7/20 | 0.50 |
| ▸ | GRIN2A | Q12879 | 7/20 | 0.50 |
| ▸ | GRIN2B | Q13224 | 7/20 | 0.50 |
| ▸ | GRIN2C | Q14957 | 7/20 | 0.50 |
| ▸ | GRIN3A | Q8TCU5 | 7/20 | 0.50 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.49 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28043610 | 1.00 | HTR3A (0.57) | HTR3AEEDS1PR5HTR3EHTR3B | |
| SCHEMBL10536080 | 0.78 | EED (0.54) | EEDMEN1KMT2AGRIN2DGRIN3B | |
| SCHEMBL29230002 | 0.78 | EED (0.55) | EEDMEN1KMT2AGRIN2DGRIN3B | |
| SCHEMBL30874288 | 0.78 | EED (0.55) | EEDMEN1KMT2AGRIN2DGRIN3B | |
| SCHEMBL2600447 | 0.77 | EED (0.72) | EEDMEN1KMT2AGRIN2DGRIN3B | |
| SCHEMBL16453893 | 0.76 | HTR3A (0.62) | HTR3AEEDGRIN2DGRIN3BGRIN1 | |
| Hydrochloric Acid SCHEMBL10535845 | 0.76 | EED (0.70) | EEDMEN1KMT2AGRIN2DGRIN3B | |
| SCHEMBL27806895 | 0.76 | DRD1 (0.56) | EED | |
| SCHEMBL31070638 | 0.76 | EED (0.51) | EEDMEN1KMT2AGRIN2DGRIN3B | |
| SCHEMBL26377274 | 0.76 | EED (0.51) | EEDMEN1KMT2AGRIN2DGRIN3B |
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-113264881-B | Synthetic method of alpha-cyanide | 南昌大学 | 2022-12-02 | — | — | CN | disclosed |