Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 2/20 | 0.49 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.49 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL28525391 | 0.88 | DRD2 (0.47) | DRD2ADRA1DADRA1AADRA1BMAPT | |
| SCHEMBL28532300 | 0.87 | ALDH1A1 (0.55) | DRD2ADRA1DADRA1AADRA1BMAPT | |
| SCHEMBL28518939 | 0.84 | SMN1; SMN2 (0.48) | MAPTHTTALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL28520443 | 0.84 | CYP19A1 (0.48) | DRD2ADRA1DADRA1AADRA1BMAPT | |
| SCHEMBL2912296 | 0.82 | ALDH1A1 (0.52) | MAPTCYP19A1HTTALDH1A1SMN1; SMN2 | |
| SCHEMBL28526104 | 0.82 | ALDH1A1 (0.48) | DRD2ADRA1DADRA1AADRA1BMAPT | |
| SCHEMBL28525574 | 0.81 | DRD2 (0.42) | DRD2ADRA1DADRA1AADRA1BMAPT | |
| SCHEMBL20242265 | 0.81 | ALDH1A1 (0.57) | MAPTHTTALDH1A1SMN1; SMN2LMNA | |
| Ammonia Solution, Strong SCHEMBL3878149 | 0.81 | ALDH1A1 (0.51) | MAPTCYP19A1HTTALDH1A1SMN1; SMN2 | |
| SCHEMBL28523902 | 0.81 | ALDH1A1 (0.60) | DRD2ADRA1DADRA1AADRA1BMAPT |
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-111836819-A | Arylamine-substituted pyrrolopyrimidine compound, and preparation method and application thereof | 北京赛特明强医药科技有限公司 | 2020-10-27 | — | — | CN | disclosed |