Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 7/20 | 0.83 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | GNAI3 | P08754 | 3/20 | 0.51 |
| ▸ | GNAO1 | P09471 | 3/20 | 0.51 |
| ▸ | GNAI1 | P63096 | 3/20 | 0.51 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.46 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.46 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.46 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.46 |
| ▸ | GUSB | P08236 | 2/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 1/20 | 0.44 |
| ▸ | DRD5 | P21918 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28290336 | 1.00 | BCHE (0.83) | BCHESMN1; SMN2KCNH2GNAI3GNAO1 | |
| SCHEMBL28290427 | 1.00 | BCHE (0.83) | BCHESMN1; SMN2KCNH2GNAI3GNAO1 | |
| Hydrochloric Acid SCHEMBL28291751 | 0.98 | BCHE (0.81) | BCHESMN1; SMN2KCNH2GNAI3GNAO1 | |
| Hydrochloric Acid SCHEMBL28291808 | 0.98 | BCHE (0.81) | BCHESMN1; SMN2KCNH2GNAI3GNAO1 | |
| Hydrochloric Acid SCHEMBL28291746 | 0.98 | BCHE (0.81) | BCHESMN1; SMN2KCNH2GNAI3GNAO1 | |
| Hydrochloric Acid SCHEMBL28872421 | 0.98 | BCHE (0.81) | BCHESMN1; SMN2KCNH2GNAI3GNAO1 | |
| SCHEMBL30444781 | 0.90 | BCHE (0.68) | BCHESMN1; SMN2KCNH2GNAI3GNAO1 | |
| SCHEMBL17351140 | 0.90 | BCHE (0.68) | BCHESMN1; SMN2KCNH2GNAI3GNAO1 | |
| SCHEMBL3933177 | 0.90 | BCHE (0.68) | BCHESMN1; SMN2KCNH2GNAI3GNAO1 | |
| SCHEMBL474297 | 0.90 | BCHE (0.68) | BCHESMN1; SMN2KCNH2GNAI3GNAO1 |
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-109641878-A | DIPROVOCIM: a new class of effective TLR agonist | 斯克里普斯研究学院 | 2019-04-16 | — | — | CN | disclosed |