Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.37 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.37 |
| ▸ | CCR8 | P51685 | 1/20 | 0.36 |
| ▸ | PPIB | P23284 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14923219 | 0.88 | ALDH1A1 (0.45) | GAARAB9AALDH1A1HPGDKMT2A | |
| SCHEMBL8288160 | 0.79 | FPR2 (0.38) | ALDH1A1HPGD | |
| SCHEMBL7520184 | 0.79 | ALDH1A1 (0.45) | RAB9AALDH1A1HPGDKMT2AKDM4E | |
| SCHEMBL8290113 | 0.78 | SIGMAR1 (0.42) | GAARAB9AALDH1A1NPC1KMT2A | |
| SCHEMBL8289020 | 0.76 | NPSR1 (0.41) | GAAALDH1A1NPC1CYP3A4KMT2A | |
| SCHEMBL14104845 | 0.74 | ATM (0.41) | ALDH1A1CYP3A4KMT2A | |
| SCHEMBL12503623 | 0.74 | SPR (0.38) | ALDH1A1 | |
| SCHEMBL10305487 | 0.74 | FPR2 (0.39) | GAAKMT2APOLB | |
| SCHEMBL17715553 | 0.72 | FPR2 (0.36) | ALDH1A1HPGDKMT2APOLB | |
| SCHEMBL12504645 | 0.71 | FPR2 (0.38) | ALDH1A1KMT2A |
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-2005058311-A1 | HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS | SCHERING CORPORATION (US) | 2005-06-30 | — | — | WO | disclosed |