Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | DRD3 | P35462 | 5/20 | 0.37 |
| ▸ | DRD2 | P14416 | 4/20 | 0.37 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.35 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.35 |
| ▸ | HRH2 | P25021 | 2/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.34 |
| ▸ | DRD4 | P21917 | 2/20 | 0.34 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4597273 | 0.81 | ALDH1A1 (0.50) | ALDH1A1MAPK1MAPTDRD3DRD2 | |
| Bromide SCHEMBL6117488 | 0.79 | ALDH1A1 (0.49) | ALDH1A1MAPK1MAPTDRD3DRD2 | |
| SCHEMBL3802844 | 0.75 | ALDH1A1 (0.56) | ALDH1A1MAPK1MAPTDRD3DRD2 | |
| SCHEMBL13125933 | 0.73 | ALDH1A1 (0.54) | ALDH1A1MAPK1MAPTDRD3DRD2 | |
| SCHEMBL31572310 | 0.71 | DRD3 (0.53) | ALDH1A1MAPK1MAPTDRD3DRD2 | |
| SCHEMBL30784645 | 0.71 | DRD3 (0.53) | ALDH1A1MAPK1MAPTDRD3DRD2 | |
| SCHEMBL13125914 | 0.71 | ALDH1A1 (0.78) | ALDH1A1MAPK1MAPTDRD3DRD2 | |
| SCHEMBL13884489 | 0.70 | ALDH1A1 (0.50) | ALDH1A1MAPK1MAPTDRD3DRD2 | |
| SCHEMBL16879855 | 0.70 | ALDH1A1 (0.40) | ALDH1A1MAPK1MAPTDRD3DRD2 | |
| SCHEMBL13125920 | 0.69 | ALDH1A1 (0.45) | ALDH1A1MAPK1MAPTDRD3DRD2 |
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-111298127-A | Composition comprising histamine release-promoting substance and inhibitory compound, and oral solid preparation containing the same | 黄泳华 | 2020-06-19 | — | — | CN | disclosed |