Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 7/20 | 0.36 |
| ▸ | DRD4 | P21917 | 4/20 | 0.36 |
| ▸ | DRD3 | P35462 | 4/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.36 |
| ▸ | DRD5 | P21918 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9835971 | 0.77 | POLB (0.41) | DRD2DRD4DRD3ADRA1AKDM4E | |
| SCHEMBL4786408 | 0.77 | DRD2 (0.37) | DRD2DRD4DRD3ADRA1AHTR2A | |
| SCHEMBL18289479 | 0.76 | AHR (0.50) | DRD2DRD4DRD3ADRA1AKDM4E | |
| SCHEMBL13243255 | 0.70 | DRD2 (0.42) | DRD2DRD4DRD3ADRA1AHTR2A | |
| SCHEMBL3032145 | 0.70 | DRD2 (0.42) | DRD2DRD4DRD3ADRA1AHTR2A | |
| SCHEMBL10305227 | 0.70 | CREBBP (0.40) | DRD2DRD4DRD3ADRA1AHTR2A | |
| SCHEMBL5519398 | 0.69 | — | — | |
| SCHEMBL8122818 | 0.67 | DRD2 (0.42) | DRD2DRD4DRD3ADRA1AHTR2A | |
| SCHEMBL3026960 | 0.67 | DRD2 (0.42) | DRD2DRD4DRD3ADRA1AHTR2A | |
| SCHEMBL13222379 | 0.67 | DRD2 (0.42) | DRD2DRD4DRD3ADRA1AKDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1235570-A2 | COMBINATIONS OF (S)-2-(BENZYLAMINO-METHYL)-2,3,8,9,-TETRAHYDRO-7H-1,4-DIOXINO(2,3)-E INDOL-8-ONE AND NEUROLEPTICS | Wyeth (US) | 2002-09-04 | — | — | EP | disclosed |
| WO-2001041750-A2 | COMBINATIONS OF (S)-2-(BENZYLAMINO-METHYL)-2,3,8,9,-TETRAHYDRO-7H-1,4-DIOXINO(2,3)-E INDOL-8-ONE AND NEUROLEPTICS | WYETH (US) | 2001-06-14 | — | — | WO | disclosed |