Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.39 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | CTSD | P07339 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | KDM1A | O60341 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8549668 | 0.89 | MEN1 (0.45) | CTSCKDM4E | |
| SCHEMBL8543973 | 0.87 | KDM4E (0.44) | CTSCKDM4ECYP3A4CYP2C19 | |
| SCHEMBL8550809 | 0.79 | METAP2 (0.46) | KDM4EKDM1AMAOAMAOB | |
| SCHEMBL8546482 | 0.78 | USP2 (0.48) | CTSCKDM4ECTSD | |
| SCHEMBL8813471 | 0.71 | KMT2A (0.46) | KDM4E | |
| SCHEMBL9283152 | 0.70 | CTSC (0.65) | CTSCKDM4EHTR2CHTR2BCYP1A2 | |
| SCHEMBL27534677 | 0.69 | CTSC (0.61) | CTSCHTR2CHTR2BCYP1A2CYP3A4 | |
| SCHEMBL5573176 | 0.69 | CTSC (0.61) | CTSCHTR2CHTR2BCYP1A2CYP3A4 | |
| SCHEMBL31332188 | 0.69 | CTSC (0.61) | CTSCHTR2CHTR2BCYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL8550327 | 0.69 | FKBP1A (0.37) | KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0564924-B1 | 2-Oxoethyl derivatives as immunosuppressants | BAYER AG (US) | 1998-09-09 | — | — | EP | claimed |