Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 11/20 | 0.60 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.58 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.58 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.58 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.58 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.58 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | HTR1A | P08908 | 1/20 | 0.58 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.58 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.58 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL28926023 | 0.87 | DRD2 (0.76) | DRD2ADRA1AMEN1CACNA1FKCNK2 | |
| SCHEMBL20254732 | 0.86 | DRD2 (0.83) | DRD2ADRA1AMEN1CACNA1FKCNK2 | |
| SCHEMBL28925968 | 0.85 | DRD2 (0.60) | DRD2ADRA1AMEN1CACNA1FKCNK2 | |
| SCHEMBL20254449 | 0.77 | DRD2 (0.83) | DRD2ADRA1AMEN1CACNA1FKCNK2 | |
| SCHEMBL11792957 | 0.77 | DRD2 (0.83) | DRD2ADRA1AMEN1CACNA1FKCNK2 | |
| SCHEMBL20248956 | 0.76 | DRD2 (0.76) | DRD2ADRA1AMEN1CACNA1FKCNK2 | |
| Chlorohaloperidol SCHEMBL4112719 | 0.76 | DRD2 (1.00) | DRD2ADRA1AMEN1CACNA1FKCNK2 | |
| SCHEMBL20254427 | 0.74 | DRD2 (0.74) | DRD2ADRA1AMEN1CACNA1FKCNK2 | |
| SCHEMBL11938907 | 0.74 | DRD2 (0.65) | DRD2ADRA1AHTR1ADRD1DRD5 | |
| SCHEMBL11796046 | 0.73 | DRD2 (0.88) | DRD2ADRA1AMEN1CACNA1FKCNK2 |
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-114456149-A | Dopamine DRD2 receptor antagonist and application thereof | 中国科学技术大学 | 2022-05-10 | — | — | CN | disclosed |