Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 1/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7408311 | 0.80 | HTR7 (0.53) | GAAMAPT | |
| SCHEMBL12244114 | 0.78 | KDM4E (0.48) | DRD3ADRA1AKDM4E | |
| SCHEMBL19139017 | 0.75 | KDM4E (0.46) | DRD3ADRA1AKDM4E | |
| SCHEMBL3065071 | 0.74 | ADRA1A (0.45) | DRD3ADRA1AKDM4E | |
| SCHEMBL12564952 | 0.69 | KDM4E (0.50) | KDM4ECYP19A1 | |
| SCHEMBL22213654 | 0.67 | DRD1 (0.64) | DRD3KDM4ECYP19A1 | |
| SCHEMBL13155632 | 0.67 | DRD1 (0.64) | DRD3KDM4ECYP19A1 | |
| SCHEMBL7407267 | 0.67 | NR2E1 (0.58) | ADRA1A | |
| SCHEMBL9688892 | 0.67 | KDM4E (0.66) | DRD3ADRA1AKDM4E | |
| SCHEMBL20695909 | 0.67 | ADRA1A (0.70) | DRD3ADRA1AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-3717638-A | 1,2,3,4,6,7,12,12A-OCTAHYDRO-2-PHENYLPYRAZINO[2',1':6,1]PYRIDO[3,4-b]INDOLES AND INTERMEDIATES THEREFOR | STERLING DRUG INC | 1973-02-20 | — | — | US | disclosed |