Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.43 |
| ▸ | HPGD | P15428 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | TNK2 | Q07912 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | LCK | P06239 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | TEK | Q02763 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8117996 | 0.88 | KDM4E (0.47) | ALDH1A1KDM4EHPGDSMN1; SMN2LMNA | |
| SCHEMBL868326 | 0.87 | KDM4E (0.49) | ALDH1A1KDM4EHPGDSMN1; SMN2LMNA | |
| SCHEMBL8117870 | 0.85 | EGLN2 (0.43) | ALDH1A1KDM4EHPGDSMN1; SMN2LMNA | |
| SCHEMBL8124545 | 0.84 | KDM4E (0.51) | ALDH1A1KDM4EHPGDSMN1; SMN2LMNA | |
| SCHEMBL4817647 | 0.82 | KDM4E (0.52) | ALDH1A1KDM4EHPGDSMN1; SMN2LMNA | |
| SCHEMBL8117811 | 0.82 | SMN1; SMN2 (0.42) | ALDH1A1KDM4EHPGDSMN1; SMN2LMNA | |
| SCHEMBL8117510 | 0.81 | KDM4E (0.54) | ALDH1A1KDM4EHPGDSMN1; SMN2LMNA | |
| SCHEMBL8116920 | 0.81 | MBOAT4 (0.46) | ALDH1A1KDM4EHPGDSMN1; SMN2GAA | |
| SCHEMBL8131234 | 0.79 | ALDH1A1 (0.48) | ALDH1A1KDM4EHPGDSMN1; SMN2GAA | |
| SCHEMBL8127031 | 0.79 | ALDH1A1 (0.52) | ALDH1A1KDM4EHPGDLMNAGAA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0782997-B1 | Triazolopyrimidine derivatives | SHELL INT RESEARCH (NL) | 2000-04-26 | — | — | EP | claimed |
| EP-0782997-A2 | Triazolopyrimidine derivatives | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1997-07-09 | — | — | EP | claimed |
| EP-0782997-B1 | Triazolopyrimidine derivatives | SHELL INT RESEARCH (NL) | 2000-04-26 | — | — | EP | disclosed |