Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | PDE4A | P27815 | 1/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.41 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.41 |
| ▸ | TAS1R3 | Q7RTX0 | 5/20 | 0.41 |
| ▸ | TAS1R1 | Q7RTX1 | 5/20 | 0.41 |
| ▸ | F11 | P03951 | 1/20 | 0.39 |
| ▸ | CFTR | P13569 | 1/20 | 0.39 |
| ▸ | IMPDH2 | P12268 | 2/20 | 0.39 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3534758 | 0.83 | ALDH1A1 (0.49) | ALDH1A1ALOX15RAB9AMEN1KMT2A | |
| SCHEMBL13082597 | 0.77 | TSHR (0.63) | ALDH1A1ALOX15RAB9AMEN1KMT2A | |
| SCHEMBL15624016 | 0.76 | CA1 (0.47) | ALDH1A1ALOX15MEN1KMT2AKDM4E | |
| SCHEMBL3538604 | 0.74 | CTSD (0.58) | ALDH1A1RAB9AMEN1KMT2AKDM4E | |
| SCHEMBL13263912 | 0.74 | ALDH1A1 (0.52) | ALDH1A1RAB9AMEN1KMT2AKDM4E | |
| SCHEMBL24890475 | 0.72 | ALOX15 (0.51) | ALDH1A1ALOX15RAB9ATAS1R3TAS1R1 | |
| SCHEMBL7621232 | 0.72 | ALOX15 (0.51) | ALDH1A1ALOX15RAB9ATAS1R3TAS1R1 | |
| SCHEMBL11577171 | 0.71 | CYP1A2 (0.70) | ALDH1A1ALOX15TAS1R3TAS1R1HPGD | |
| SCHEMBL1419879 | 0.71 | ALDH1A1 (0.62) | ALDH1A1RAB9AKDM4EUSP2F11 | |
| SCHEMBL7001839 | 0.71 | ALDH1A1 (0.65) | ALDH1A1MEN1KMT2AKDM4EUSP2 |
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-2006009653-A1 | AMINO-5,5-DIPHENYLIMIDAZOLONE DERIVATIVES FOR THE INHIBITION OF BETA-SECRETASE | WYETH (US) | 2006-01-26 | — | — | WO | disclosed |