Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | ALOX15B | O15296 | 1/20 | 0.30 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | MMP9 | P14780 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL10832767 | 0.80 | CYP3A4 (0.33) | CYP3A4MAPK1MEN1LMNAMAPT | |
| SCHEMBL11205297 | 0.78 | MAPK1 (0.37) | CYP3A4MAPK1MEN1ALDH1A1LMNA | |
| SCHEMBL511713 | 0.67 | — | — | |
| SCHEMBL2935032 | 0.62 | DPP4 (0.52) | DPP4CYP3A4MAPK1MEN1ALDH1A1 | |
| SCHEMBL2517467 | 0.61 | TDP1 (0.45) | CYP3A4KDM4EALDH1A1MAPTHTT | |
| SCHEMBL13271196 | 0.61 | NQO2 (0.44) | DPP4CYP3A4MAPK1KDM4EMEN1 | |
| SCHEMBL9757055 | 0.61 | DPP4 (0.43) | DPP4KDM4EMEN1ALDH1A1TP53 | |
| SCHEMBL938857 | 0.60 | SMN1; SMN2 (0.32) | KDM4EMEN1ALDH1A1LMNAMAPT | |
| SCHEMBL13439505 | 0.60 | NQO2 (0.42) | DPP4CYP3A4MAPK1KDM4EMEN1 | |
| SCHEMBL5438983 | 0.59 | — | — |
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-0092830-A2 | Cephalosporin derivatives, process for their preparation, pharmaceutical compositions containing them and their application | CIBA-GEIGY AG (CH) | 1983-11-02 | — | — | EP | disclosed |