Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.49 |
| ▸ | MAPT | P10636 | 7/20 | 0.49 |
| ▸ | HTT | P42858 | 4/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.49 |
| ▸ | PPP1CA | P62136 | 2/20 | 0.49 |
| ▸ | ALPL | P05186 | 1/20 | 0.49 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 7/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 6/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | METAP2 | P50579 | 1/20 | 0.46 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.43 |
| ▸ | MMP2 | P08253 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 4/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 3/20 | 0.42 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL12631334 | 1.00 | ALDH1A1 (0.49) | ALDH1A1KDM4EMAPTHTTTDP1 | |
| SCHEMBL2164723 | 0.89 | ALDH1A1 (0.43) | ALDH1A1KDM4EMAPTHTTTDP1 | |
| SCHEMBL2164240 | 0.88 | ALDH1A1 (0.41) | ALDH1A1KDM4EMAPTHTTTDP1 | |
| SCHEMBL2163761 | 0.88 | ALDH1A1 (0.41) | ALDH1A1KDM4EMAPTHTTTDP1 | |
| SCHEMBL12631388 | 0.88 | ALDH1A1 (0.41) | ALDH1A1KDM4EMAPTHTTTDP1 | |
| SCHEMBL12632109 | 0.87 | SLC40A1 (0.46) | ALDH1A1KDM4EMAPTHTTTDP1 | |
| SCHEMBL2163163 | 0.87 | DRD4 (0.43) | ALDH1A1KDM4EMAPTHTTTDP1 | |
| SCHEMBL2164596 | 0.87 | ALDH1A1 (0.41) | ALDH1A1KDM4EMAPTHTTTDP1 | |
| SCHEMBL2163275 | 0.86 | ALDH1A1 (0.40) | ALDH1A1KDM4EMAPTHTTTDP1 | |
| SCHEMBL2016205 | 0.86 | ALDH1A1 (0.40) | ALDH1A1KDM4EMAPTHTTTDP1 |
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-2011075630-A1 | SUBSTITUTED FUSED ARYL AND HETEROARYL DERIVATIVES AS PI3K INHIBITORS | INCYTE CORPORATION (US) | 2011-06-23 | — | — | WO | disclosed |