Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | XBP1 | P17861 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 3/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 6/20 | 0.32 |
| ▸ | CALCRL | Q16602 | 1/20 | 0.31 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.30 |
| ▸ | CTSL | P07711 | 1/20 | 0.30 |
| ▸ | CTSB | P07858 | 1/20 | 0.30 |
| ▸ | CTSK | P43235 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7094224 | 0.95 | ALDH1A1 (0.34) | KDM4EALDH1A1RCE1IDO1PLA2G1B | |
| SCHEMBL7704930 | 0.87 | SMYD3 (0.38) | KDM4EALDH1A1RCE1IDO1SCN9A | |
| SCHEMBL7089999 | 0.86 | KDM4E (0.37) | KDM4EALDH1A1RCE1IDO1PLA2G1B | |
| SCHEMBL7708204 | 0.86 | IDO1 (0.39) | KDM4EALDH1A1RCE1IDO1CALCRL | |
| SCHEMBL7704928 | 0.81 | SMYD3 (0.35) | IDO1SMYD3 | |
| SCHEMBL7705017 | 0.80 | ALDH1A1 (0.34) | KDM4EALDH1A1RCE1IDO1PLA2G1B | |
| SCHEMBL7092653 | 0.78 | KDM4E (0.39) | KDM4EALDH1A1RCE1IDO1PLA2G1B | |
| SCHEMBL7704943 | 0.76 | ALDH1A1 (0.43) | ALDH1A1MAPTHPGDXBP1HTT | |
| SCHEMBL7711316 | 0.75 | CTSS (0.38) | KDM4EALDH1A1RCE1IDO1PLA2G1B | |
| SCHEMBL6304809 | 0.74 | MAPT (0.39) | KDM4EALDH1A1RCE1PLA2G1BMAPT |
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-1015437-B1 | BENZOXAZINE AND BENZOTHIAZINE DERIVATIVES AND THEIR USE IN PHARMACEUTICALS | SCHERING AG (DE) | 2003-12-03 | — | — | EP | disclosed |
| US-6365736-B1 | TREATMENT OF NERVOUS SYSTEM DISORDERS, CARDIOVASCULAR DISORDERS AND FOR ACTIVITY AS NO-SYNTHASES (NOS) INHIBITORS. | SCHERING AKTIENGESELLSCHAFT (DE) | 2002-04-02 | — | — | US | disclosed |