Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | QDPR | P09417 | 1/20 | 0.48 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 5/20 | 0.43 |
| ▸ | DRD3 | P35462 | 4/20 | 0.43 |
| ▸ | DRD4 | P21917 | 3/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ESRRB | O95718 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ESRRG | P62508 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7301945 | 0.85 | PPARG (0.47) | PARP1DRD2SIGMAR1 | |
| SCHEMBL7294958 | 0.75 | QDPR (0.55) | QDPRPARP1DRD2DRD3DRD4 | |
| SCHEMBL7305701 | 0.75 | QDPR (0.55) | QDPRPARP1DRD2DRD3DRD4 | |
| SCHEMBL11932475 | 0.72 | SIGMAR1 (0.61) | PARP1DRD2SIGMAR1HTR1A | |
| SCHEMBL7303423 | 0.72 | QDPR (0.51) | QDPRPARP1DRD2DRD3DRD4 | |
| SCHEMBL16843071 | 0.72 | SIGMAR1 (0.50) | DRD2SIGMAR1KCNH2 | |
| SCHEMBL9967722 | 0.71 | SIGMAR1 (0.56) | SIGMAR1HTR1A | |
| SCHEMBL18937658 | 0.69 | SIGMAR1 (0.60) | QDPRPARP1DRD2DRD3DRD4 | |
| SCHEMBL18937665 | 0.68 | QDPR (0.50) | QDPRPARP1DRD2DRD3DRD4 | |
| SCHEMBL4233519 | 0.68 | SIGMAR1 (0.53) | DRD2SIGMAR1HTR1ATDP1NAMPT |
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-5149817-A | Psychotropic agents | SHIONOGI & CO., LTD. (JP) | 1992-09-22 | — | — | US | disclosed |
| EP-0445701-A1 | Novel tetrahydropyridine derivatives | SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) | 1991-09-11 | — | — | EP | disclosed |