Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 2/20 | 0.42 |
| ▸ | DRD4 | P21917 | 2/20 | 0.42 |
| ▸ | DRD3 | P35462 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MC4R | P32245 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9050217 | 0.83 | DRD4 (0.48) | KMT2AMEN1KDM4EDRD2DRD4 | |
| SCHEMBL9048831 | 0.81 | LMNA (0.48) | DRD2DRD4DRD3LMNAPOLB | |
| SCHEMBL9050813 | 0.77 | ADRA1D (0.45) | KMT2AMEN1DRD2DRD4DRD3 | |
| SCHEMBL8861851 | 0.74 | SLC6A4 (0.51) | TSHRCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9039441 | 0.74 | LMNA (0.52) | KMT2AMEN1KDM4EDRD2DRD4 | |
| SCHEMBL8861909 | 0.73 | KMT2A (0.47) | KMT2AMEN1KDM4EDRD2DRD4 | |
| Hydrochloric Acid SCHEMBL8964106 | 0.71 | TSHR (0.47) | KMT2AMEN1KDM4EDRD2DRD4 | |
| SCHEMBL8861888 | 0.71 | KMT2A (0.47) | KMT2AMEN1KDM4EDRD2DRD4 | |
| SCHEMBL16226120 | 0.70 | CYP2D6 (0.69) | KMT2AMEN1KDM4EDRD2DRD4 | |
| SCHEMBL16226702 | 0.70 | CYP2D6 (0.69) | KMT2AMEN1KDM4EDRD2DRD4 |
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-0730582-A1 | ISOXAZOLE AND PYRAZOLE DERIVATIVES AS DOPAMINE RECEPTOR SUBTYPE LIGANDS | MERCK SHARP & DOHME LTD. (GB) | 1996-09-11 | — | — | EP | disclosed |
| WO-1995014672-A1 | ISOXAZOLE AND PYRAZOLE DERIVATIVES AS DOPAMINE RECEPTOR SUBTYPE LIGANDS | MERCK SHARP & DOHME LIMITED (GB) | 1995-06-01 | — | — | WO | disclosed |