Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.43 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.41 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.40 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 7/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10699043 | 0.82 | CA1 (0.48) | ALDH1A1TSHRMAPK1MAPTGAA | |
| SCHEMBL6153059 | 0.81 | KMT2A (0.48) | SMN1; SMN2ALDH1A1MAPK1MAPTHTT | |
| SCHEMBL6399385 | 0.81 | MAPK1 (0.51) | PLK1SMN1; SMN2ALDH1A1MAPK1EPHX2 | |
| SCHEMBL6400649 | 0.81 | POLB (0.44) | SMN1; SMN2ALDH1A1MAPK1MAPTKDM4E | |
| SCHEMBL5183124 | 0.80 | SRC (0.51) | SMN1; SMN2ALDH1A1TSHRMAPK1MAPT | |
| SCHEMBL14632299 | 0.79 | EPHX2 (0.44) | SMN1; SMN2ALDH1A1EPHX2NR1H4MAPT | |
| SCHEMBL9733471 | 0.79 | ALDH1A1 (0.36) | PLK1SMN1; SMN2ALDH1A1MAPTGAA | |
| SCHEMBL17295068 | 0.75 | HAO1 (0.58) | PLK1SMN1; SMN2ALDH1A1TSHRMAPK1 | |
| SCHEMBL5768900 | 0.75 | HAO1 (0.58) | PLK1SMN1; SMN2ALDH1A1TSHRMAPK1 | |
| SCHEMBL13610814 | 0.74 | ALDH1A1 (0.56) | PLK1SMN1; SMN2ALDH1A1TSHRMAPK1 |
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-0252639-A1 | Leukotriene antagonists | MERCK FROSST CANADA INC. (CA) | 1988-01-13 | — | — | EP | disclosed |
| EP-0104885-B1 | LEUKOTRIENE ANTAGONISTS, THEIR PRODUCTION, AND COMPOSITIONS CONTAINING THEM | MERCK FROSST CANADA INC. (CA) | 1986-06-04 | — | — | EP | disclosed |