Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.55 |
| ▸ | GAA | P10253 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | EGFR | P00533 | 1/20 | 0.49 |
| ▸ | THRA | P10827 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CRHBP | P24387 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | CASP1 | P29466 | 1/20 | 0.48 |
| ▸ | CASP7 | P55210 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL4601631 | 0.91 | L3MBTL1 (0.53) | KDM4EGAAALDH1A1SMN1; SMN2L3MBTL1 | |
| SCHEMBL7331535 | 0.86 | RARB (0.63) | KDM4EPTPN11TP53TSHRRARB | |
| SCHEMBL2039160 | 0.85 | KDM4E (0.58) | KDM4EGAAALDH1A1SMN1; SMN2L3MBTL1 | |
| SCHEMBL7444771 | 0.84 | KDM4E (0.47) | KDM4EGAAALDH1A1SMN1; SMN2L3MBTL1 | |
| SCHEMBL10871804 | 0.84 | RARB (0.63) | KDM4ETHRATHRBPTPN11TP53 | |
| SCHEMBL3977527 | 0.84 | RARB (0.63) | KDM4ETHRATHRBPTPN11TP53 | |
| SCHEMBL6266863 | 0.84 | RARB (0.63) | KDM4ETHRATHRBPTPN11TP53 | |
| SCHEMBL8986580 | 0.84 | RARB (0.63) | KDM4ETHRATHRBPTPN11TP53 | |
| SCHEMBL8769909 | 0.84 | RARB (0.63) | KDM4ETHRATHRBPTPN11TP53 | |
| SCHEMBL9723851 | 0.84 | RARB (0.63) | KDM4ETHRATHRBPTPN11TP53 |
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 |
|---|---|---|---|---|---|---|---|
| US-5541160-A | ECHINOCANDINS | MERCK & CO., INC. (US) | 1996-07-30 | — | — | US | disclosed |
| WO-1995008341-A1 | ANTIFUNGAL AND ANTI-PNEUMOCYSTIS COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS, AND METHODS OF USE | MERCK & CO., INC. (US) | 1995-03-30 | — | — | WO | disclosed |