Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 12/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.66 |
| ▸ | HSD17B10 | Q99714 | 9/20 | 0.65 |
| ▸ | HPGD | P15428 | 8/20 | 0.65 |
| ▸ | CASP1 | P29466 | 5/20 | 0.65 |
| ▸ | TSHR | P16473 | 2/20 | 0.65 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.65 |
| ▸ | CASP7 | P55210 | 3/20 | 0.61 |
| ▸ | GAA | P10253 | 3/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.61 |
| ▸ | MEN1 | O00255 | 2/20 | 0.61 |
| ▸ | POLB | P06746 | 2/20 | 0.61 |
| ▸ | ESR1 | P03372 | 1/20 | 0.61 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.61 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | KLK7 | P49862 | 1/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9301152 | 0.87 | KDM4E (0.69) | KDM4EALDH1A1HSD17B10HPGDCASP1 | |
| SCHEMBL10621742 | 0.85 | KDM4E (0.60) | KDM4EALDH1A1HSD17B10HPGDCASP1 | |
| SCHEMBL9300908 | 0.85 | KDM4E (0.66) | KDM4EALDH1A1HSD17B10HPGDCASP1 | |
| SCHEMBL9300361 | 0.83 | KDM4E (0.64) | KDM4EALDH1A1HSD17B10HPGDCASP1 | |
| SCHEMBL9300611 | 0.81 | KDM4E (0.55) | KDM4EALDH1A1HSD17B10HPGDCASP1 | |
| SCHEMBL10530609 | 0.80 | KDM4E (0.44) | KDM4EALDH1A1HSD17B10HPGDCASP1 | |
| SCHEMBL14014111 | 0.80 | KDM4E (1.00) | KDM4EALDH1A1HSD17B10HPGDCASP1 | |
| SCHEMBL10617852 | 0.80 | KDM4E (0.54) | KDM4EALDH1A1HSD17B10HPGDCASP1 | |
| SCHEMBL13723869 | 0.78 | ALDH1A1 (0.82) | KDM4EALDH1A1HSD17B10HPGDCASP1 | |
| SCHEMBL14013782 | 0.76 | ALDH1A1 (0.79) | KDM4EALDH1A1HSD17B10HPGDCASP1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5319140-A | Antibiotics | HOFFMANN-LA ROCHE INC. (US) | 1994-06-07 | — | — | US | disclosed |
| US-5138066-A | Intermediates for cephalosporins with sulfur-containing oxyimino side chain | HOFFMANN-LA ROCHE, INC. (US) | 1992-08-11 | — | — | US | disclosed |
| US-5073550-A | Bactericides | HOFFMANN-LA ROCHE INC. (US) | 1991-12-17 | — | — | US | disclosed |
| US-5036064-A | Antibiotics | HOFFMANN-LA ROCHE INC. (US) | 1991-07-30 | — | — | US | disclosed |
| EP-0286145-A2 | 3-Heterocyclylthiomethyl cephalosporins | SANKEI PHARMACEUTICAL COMPANY LIMITED (JP) | 1988-10-12 | — | — | EP | disclosed |