Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.69 |
| ▸ | GAA | P10253 | 6/20 | 0.69 |
| ▸ | MAPT | P10636 | 3/20 | 0.69 |
| ▸ | NPC1 | O15118 | 2/20 | 0.69 |
| ▸ | RAB9A | P51151 | 2/20 | 0.69 |
| ▸ | TP53 | P04637 | 1/20 | 0.69 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.69 |
| ▸ | HPGD | P15428 | 5/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.48 |
| ▸ | TUBB4A | P04350 | 3/20 | 0.47 |
| ▸ | TUBB | P07437 | 3/20 | 0.47 |
| ▸ | TUBA3C | P0DPH7 | 3/20 | 0.47 |
| ▸ | TUBA1B | P68363 | 3/20 | 0.47 |
| ▸ | TUBA4A | P68366 | 3/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL385458 | 0.85 | ALDH1A1 (0.57) | KDM4EALDH1A1GAAMAPTNPC1 | |
| SCHEMBL17600647 | 0.85 | ALDH1A1 (0.57) | KDM4EALDH1A1GAAMAPTNPC1 | |
| SCHEMBL17600661 | 0.84 | ALOX15 (0.57) | KDM4EALDH1A1GAAMAPTNPC1 | |
| SCHEMBL28746471 | 0.83 | KDM4E (0.82) | KDM4EALDH1A1GAAMAPTNPC1 | |
| SCHEMBL14174305 | 0.82 | ALDH1A1 (0.76) | KDM4EALDH1A1GAAMAPTNPC1 | |
| SCHEMBL31682820 | 0.82 | ALDH1A1 (0.76) | KDM4EALDH1A1GAAMAPTNPC1 | |
| SCHEMBL17600644 | 0.81 | ALDH1A1 (0.53) | KDM4EALDH1A1GAAMAPTNPC1 | |
| SCHEMBL17600659 | 0.81 | ALDH1A1 (0.53) | KDM4EALDH1A1GAAMAPTNPC1 | |
| SCHEMBL13758172 | 0.80 | ALDH1A1 (0.76) | KDM4EALDH1A1GAAMAPTNPC1 | |
| SCHEMBL6924414 | 0.78 | ALDH1A1 (0.51) | KDM4EALDH1A1GAAMAPTNPC1 |
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 |