Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4D | Q08499 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.38 |
| ▸ | PLAU | P00749 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 2/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL10193249 | 0.90 | BACE1 (0.43) | PDE4DBACE1 | |
| SCHEMBL10193220 | 0.87 | SMN1; SMN2 (0.49) | SMN1; SMN2ALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL10194907 | 0.87 | SMN1; SMN2 (0.38) | PDE4DSMN1; SMN2ALDH1A1MEN1KMT2A | |
| SCHEMBL10192934 | 0.86 | BACE1 (0.45) | BACE1 | |
| SCHEMBL10192951 | 0.86 | BACE1 (0.48) | BACE1 | |
| SCHEMBL10194914 | 0.86 | ALDH1A1 (0.43) | SMN1; SMN2ALDH1A1MEN1KMT2APOLB | |
| SCHEMBL10193706 | 0.84 | NPC1 (0.39) | PDE4DSMN1; SMN2ALDH1A1MEN1KMT2A | |
| SCHEMBL10194912 | 0.81 | PRSS1 (0.46) | SMN1; SMN2ALDH1A1MEN1KMT2APOLB | |
| SCHEMBL10193944 | 0.76 | KDM4E (0.43) | ALDH1A1NPC1RAB9AKDM4EBACE1 | |
| SCHEMBL10192941 | 0.74 | BACE1 (0.44) | BACE1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2415756-A1 | ISOTHIOUREA DERIVATIVES OR ISOUREA DERIVATIVES HAVING BACE1 INHIBITORY ACTIVITY | Shionogi&Co., Ltd. (JP) | 2012-02-08 | — | — | EP | disclosed |