Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 8/20 | 0.49 |
| ▸ | DRD2 | P14416 | 2/20 | 0.46 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.36 |
| ▸ | TAB1 | Q15750 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14919674 | 0.91 | DRD2 (0.50) | DRD2HSD11B1HTR1AHTR2AEPHX1 | |
| SCHEMBL15226075 | 0.83 | EPHX1 (0.55) | HSD11B1EPHX1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL2226733 | 0.82 | GAA (0.55) | DRD2HSD11B1HTR1AHTR2AEPHX1 | |
| SCHEMBL12513640 | 0.82 | DRD2 (0.45) | DRD2HSD11B1HTR1AHTR2AEPHX1 | |
| SCHEMBL12436657 | 0.82 | DRD2 (0.45) | DRD2HSD11B1HTR1AHTR2AEPHX1 | |
| SCHEMBL1693037 | 0.82 | DRD2 (0.50) | DRD2HSD11B1HTR1AHTR2AEPHX1 | |
| SCHEMBL6484001 | 0.81 | SMYD3 (0.60) | SMYD3DRD2HSD11B1EPHX1TSHR | |
| SCHEMBL9924028 | 0.81 | SMYD3 (0.60) | SMYD3DRD2HSD11B1EPHX1TSHR | |
| SCHEMBL643094 | 0.80 | EPHX1 (0.48) | SMYD3DRD2HSD11B1HTR1AHTR2A | |
| Bicarbonate SCHEMBL15225614 | 0.80 | EPHX1 (0.53) | DRD2HSD11B1EPHX1RAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011149841-A1 | SUBSTITUTED THIAZOLIDINEDIONE INDAZOLES, INDOLES AND BENZOTRIAZOLES AS ESTROGEN-RELATED RECEPTOR-α MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2011-12-01 | — | — | WO | disclosed |