Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 5/20 | 0.62 |
| ▸ | CA1 | P00915 | 4/20 | 0.62 |
| ▸ | CA2 | P00918 | 4/20 | 0.62 |
| ▸ | DRD2 | P14416 | 4/20 | 0.60 |
| ▸ | DRD3 | P35462 | 4/20 | 0.60 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.60 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.60 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.51 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.51 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.48 |
| ▸ | HTR1D | P28221 | 1/20 | 0.46 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.45 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL11009077 | 0.95 | DRD2 (0.67) | ACHECA1CA2DRD2DRD3 | |
| SCHEMBL11005303 | 0.85 | DRD2 (0.58) | ACHECA1CA2DRD2DRD3 | |
| Hydrochloric Acid SCHEMBL11005295 | 0.84 | DRD2 (0.57) | ACHECA1CA2DRD2DRD3 | |
| SCHEMBL10765415 | 0.82 | DRD2 (0.71) | ACHECA1CA2DRD2DRD3 | |
| SCHEMBL11493562 | 0.82 | DRD2 (0.71) | ACHECA1CA2DRD2DRD3 | |
| SCHEMBL18983605 | 0.81 | CA1 (0.58) | ACHECA1CA2DRD2DRD3 | |
| Hydrochloric Acid SCHEMBL11443133 | 0.81 | DRD2 (0.69) | ACHECA1CA2DRD2DRD3 | |
| SCHEMBL11007069 | 0.81 | DRD2 (0.65) | ACHECA1CA2DRD2DRD3 | |
| SCHEMBL607070 | 0.80 | DRD2 (0.90) | ACHECA1CA2DRD2DRD3 | |
| SCHEMBL3975748 | 0.80 | MTNR1A (0.90) | ACHECA1CA2DRD2DRD3 |
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 |
|---|---|---|---|---|---|---|---|
| US-4521607-A | HYPOTENSIVE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1985-06-04 | — | — | US | disclosed |
| EP-0035868-A1 | Bicyclic compounds, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1981-09-16 | — | — | EP | disclosed |