Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.62 |
| ▸ | MAPT | P10636 | 5/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.62 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 4/20 | 0.48 |
| ▸ | LMNA | P02545 | 4/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | BRAF | P15056 | 1/20 | 0.36 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.36 |
| ▸ | STAT6 | P42226 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL6826630 | 0.88 | KDM4E (0.60) | KDM4EALDH1A1MAPTMAPK1POLB | |
| SCHEMBL6826652 | 0.81 | ABCB1 (0.54) | KDM4EALDH1A1MAPTMAPK1POLB | |
| SCHEMBL6828569 | 0.80 | BRAF (0.54) | KDM4EALDH1A1MAPTMAPK1POLB | |
| SCHEMBL31219113 | 0.79 | KDM4E (0.72) | KDM4EALDH1A1MAPTMAPK1POLB | |
| SCHEMBL17396514 | 0.79 | KDM4E (0.72) | KDM4EALDH1A1MAPTMAPK1POLB | |
| SCHEMBL6826964 | 0.79 | KDM4E (0.50) | KDM4EALDH1A1MAPTMAPK1POLB | |
| SCHEMBL6822894 | 0.78 | POLB (0.55) | KDM4EALDH1A1MAPTMAPK1POLB | |
| SCHEMBL6827207 | 0.77 | MAPT (0.60) | KDM4EALDH1A1MAPTMAPK1POLB | |
| SCHEMBL18496507 | 0.77 | KDM4E (1.00) | KDM4EALDH1A1MAPTMAPK1POLB | |
| SCHEMBL6826428 | 0.77 | KDM4E (0.68) | KDM4EALDH1A1MAPTMAPK1POLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004111052-A1 | PYRROLOPYRIMIDINE DERIVATIVES AS MODULATORS OF MULTI-DRUG RESISTANCE (MDR) | XENOVA LIMITED (GB) | 2004-12-23 | — | — | WO | disclosed |