Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.33 |
| ▸ | MEN1 | O00255 | 4/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 9/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 9/20 | 0.33 |
| ▸ | CASP1 | P29466 | 7/20 | 0.33 |
| ▸ | CASP7 | P55210 | 7/20 | 0.33 |
| ▸ | CLK4 | Q9HAZ1 | 5/20 | 0.33 |
| ▸ | USP2 | O75604 | 5/20 | 0.33 |
| ▸ | TSHR | P16473 | 4/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.33 |
| ▸ | GLA | P06280 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13373400 | 0.86 | ALDH1A1 (0.33) | GAAL3MBTL1ALDH1A1MEN1KMT2A | |
| SCHEMBL13373297 | 0.81 | CCNE1 (0.40) | ALDH1A1MEN1KMT2ACYP1A2HSD17B10 | |
| SCHEMBL13373339 | 0.81 | ALDH1A1 (0.32) | GAAALDH1A1MEN1KMT2ACYP1A2 | |
| SCHEMBL13373284 | 0.80 | ADORA2A (0.32) | GAAL3MBTL1ALDH1A1MEN1KMT2A | |
| SCHEMBL13373271 | 0.78 | ALDH1A1 (0.32) | GAAL3MBTL1ALDH1A1MEN1KMT2A | |
| SCHEMBL13373340 | 0.77 | ADORA1 (0.37) | ALDH1A1MEN1KMT2AKDM4EMAPT | |
| SCHEMBL13373279 | 0.76 | CDK2 (0.42) | ALDH1A1MEN1KMT2ACYP1A2HSD17B10 | |
| SCHEMBL13373311 | 0.75 | ALDH1A1 (0.33) | GAAALDH1A1MEN1KMT2ACYP1A2 | |
| SCHEMBL13373283 | 0.74 | CCNE1 (0.33) | GAAALDH1A1MEN1KMT2ACYP1A2 | |
| SCHEMBL13373382 | 0.74 | ALDH1A1 (0.36) | GAAALDH1A1MEN1KMT2AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-8288400-B2 | Compositions useful as inhibitors of protein kinases | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2012-10-16 | — | — | US | disclosed |