Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.70 |
| ▸ | MEN1 | O00255 | 4/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.62 |
| ▸ | LMNA | P02545 | 2/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.62 |
| ▸ | RAB9A | P51151 | 6/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.59 |
| ▸ | NPC1 | O15118 | 4/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 4/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
| ▸ | IDH1 | O75874 | 1/20 | 0.51 |
| ▸ | GFER | P55789 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL4718073 | 0.84 | KMT2A (0.69) | MEN1KMT2ARAB9ANPC1MAPT | |
| SCHEMBL4749975 | 0.82 | MEN1 (0.60) | ALDH1A1MEN1KMT2ALMNARAB9A | |
| SCHEMBL3939402 | 0.81 | ALDH1A1 (0.77) | ALDH1A1MEN1KMT2ALMNAMAPK1 | |
| SCHEMBL3939400 | 0.81 | ALDH1A1 (0.77) | ALDH1A1MEN1KMT2ALMNAMAPK1 | |
| SCHEMBL5728822 | 0.81 | RAB9A (0.77) | ALDH1A1MEN1KMT2ALMNAMAPK1 | |
| SCHEMBL4718568 | 0.80 | ALDH1A1 (0.60) | ALDH1A1MEN1KMT2ALMNAMAPK1 | |
| SCHEMBL13169441 | 0.78 | IDH1 (0.57) | ALDH1A1MEN1KMT2AMAPK1RAB9A | |
| SCHEMBL12049693 | 0.76 | IDH1 (0.54) | ALDH1A1MEN1KMT2ALMNAMAPK1 | |
| SCHEMBL1025225 | 0.74 | MEN1 (0.56) | ALDH1A1MEN1KMT2ALMNARAB9A | |
| SCHEMBL9817301 | 0.74 | ALDH1A1 (0.65) | ALDH1A1MEN1KMT2ALMNAMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009100536-A1 | INHIBITORS OF KINASE ACTIVITY WITH 1,2-DI-CYCLYL SUBSTITUTED ALKYNE STRUCTURES | METHYLGENE INC. (CA) | 2009-08-20 | — | — | WO | disclosed |
| WO-2009100536-A1 | INHIBITORS OF KINASE ACTIVITY WITH 1,2-DI-CYCLYL SUBSTITUTED ALKYNE STRUCTURES | METHYLGENE INC. (CA) | 2009-08-20 | — | — | WO | disclosed |