Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.76 |
| ▸ | AR | P10275 | 1/20 | 0.65 |
| ▸ | KRAS | P01116 | 2/20 | 0.64 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.63 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.63 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.63 |
| ▸ | MAPT | P10636 | 5/20 | 0.61 |
| ▸ | MAOB | P27338 | 5/20 | 0.61 |
| ▸ | MAOA | P21397 | 3/20 | 0.61 |
| ▸ | BCHE | P06276 | 1/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | LMNA | P02545 | 3/20 | 0.59 |
| ▸ | HTT | P42858 | 2/20 | 0.59 |
| ▸ | NPC1 | O15118 | 1/20 | 0.59 |
| ▸ | TP53 | P04637 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | RAB9A | P51151 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL14318105 | 1.00 | ABCG2 (0.76) | ABCG2ARKRASHSP90AA1NR2F2 | |
| SCHEMBL14306018 | 0.86 | HSP90AA1 (0.79) | ABCG2ARHSP90AA1MAPTMAOB | |
| SCHEMBL15807299 | 0.86 | MAPT (0.67) | ABCG2KRASMAPTMAOBMAOA | |
| SCHEMBL15807366 | 0.86 | KRAS (0.66) | ABCG2KRASMAPTMAOBMAOA | |
| SCHEMBL14306002 | 0.85 | KRAS (0.65) | ABCG2KRASMAPTMAOBMAOA | |
| SCHEMBL14249195 | 0.85 | KRAS (0.65) | ABCG2KRASMAPTMAOBMAOA | |
| SCHEMBL14315251 | 0.84 | MAPT (0.81) | ABCG2KRASMAPTMAOBMAOA | |
| SCHEMBL14317395 | 0.84 | ABCG2 (0.78) | ABCG2KRASMAPTMAOBMAOA | |
| SCHEMBL15631510 | 0.83 | ABCG2 (0.91) | ABCG2MAPTMAOBMAOAALDH1A1 | |
| SCHEMBL4254947 | 0.83 | ABCG2 (0.90) | ABCG2ARMAPTMAOBBCHE |
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-2015075051-A1 | ALLOSTERIC INHIBITORS OF ATYPICAL PROTEIN KINASES C | UNIVERSITAET DES SAARLANDES (DE) | 2015-05-28 | — | — | WO | disclosed |