Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CDYL2 | Q8N8U2 | 7/20 | 0.41 |
| ▸ | CDYL | Q9Y232 | 6/20 | 0.41 |
| ▸ | CDY1; CDY1B | Q9Y6F8 | 6/20 | 0.41 |
| ▸ | CBX7 | O95931 | 6/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL12963052 | 0.86 | SMN1; SMN2 (0.45) | CA12CA9SMN1; SMN2NPC1MAPT | |
| SCHEMBL10314637 | 0.73 | CDYL2 (0.52) | CA12CA9SMN1; SMN2NPC1MAPT | |
| SCHEMBL1063569 | 0.73 | CDYL2 (0.48) | CA12CA9SMN1; SMN2NPC1MAPT | |
| SCHEMBL1058048 | 0.71 | SMN1; SMN2 (0.47) | CA12CA9SMN1; SMN2NPC1MAPT | |
| SCHEMBL17677357 | 0.71 | MAPT (0.49) | CA12CA9SMN1; SMN2NPC1MAPT | |
| SCHEMBL10314590 | 0.67 | SMN1; SMN2 (0.48) | SMN1; SMN2NPC1MAPTRAB9AKDM4E | |
| SCHEMBL1061180 | 0.67 | SMO (0.56) | SMN1; SMN2NPC1MAPTRAB9AKDM4E | |
| SCHEMBL17667839 | 0.64 | MAPT (0.44) | CA12CA9SMN1; SMN2NPC1MAPT | |
| SCHEMBL30666361 | 0.64 | ALDH1A1 (0.59) | CA12CA9SMN1; SMN2NPC1MAPT | |
| SCHEMBL382162 | 0.62 | ALDH1A1 (0.56) | SMN1; SMN2NPC1MAPTRAB9AKDM4E |
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-8399449-B2 | Fused heterocyclic derivative and use thereof | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2013-03-19 | — | — | US | disclosed |