Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.47 |
| ▸ | SLC18A3 | Q16572 | 3/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.46 |
| ▸ | DRD2 | P14416 | 2/20 | 0.45 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.41 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.39 |
| ▸ | DRD1 | P21728 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | DRD5 | P21918 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL594418 | 0.84 | ESR2 (0.61) | ESR2SLC18A3SIGMAR1DRD2CARM1 | |
| SCHEMBL10765237 | 0.83 | ESR2 (0.55) | ESR2SLC18A3SIGMAR1DRD2CARM1 | |
| SCHEMBL10765232 | 0.83 | ESR2 (0.55) | ESR2SLC18A3SIGMAR1DRD2CARM1 | |
| SCHEMBL10091159 | 0.83 | ESR2 (0.55) | ESR2SLC18A3SIGMAR1DRD2CARM1 | |
| SCHEMBL10091160 | 0.78 | ESR2 (0.50) | ESR2SLC18A3SIGMAR1DRD2CARM1 | |
| SCHEMBL19207133 | 0.77 | ESR2 (0.53) | ESR2SLC18A3SIGMAR1DRD2DRD1 | |
| Formic Acid SCHEMBL18406241 | 0.74 | ESR2 (0.55) | ESR2SLC18A3SIGMAR1DRD2KDM4E | |
| SCHEMBL10091181 | 0.74 | ESR2 (0.50) | ESR2SLC18A3SIGMAR1DRD2KDM4E | |
| Formic Acid SCHEMBL18406242 | 0.74 | ESR2 (0.50) | ESR2SLC18A3SIGMAR1DRD2KDM4E | |
| SCHEMBL11196166 | 0.73 | ESR2 (0.77) | ESR2SLC18A3SIGMAR1DRD2 |
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-5514684-A | Aconitine compounds and analgesic/anti-inflammatory agent containing the same | SANWA SHOYAKU KABUSHIKI KAISHA (JP) | 1996-05-07 | — | — | US | disclosed |