Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 4/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3410924 | 0.93 | ALDH1A1 (0.61) | ALDH1A1HTTTSHRNPC1KDM4E | |
| SCHEMBL18153261 | 0.80 | ALDH1A1 (0.64) | ALDH1A1HTTTSHRNPC1KDM4E | |
| SCHEMBL17608998 | 0.79 | ALDH1A1 (0.53) | ALDH1A1HTTTSHRNPC1KDM4E | |
| SCHEMBL19510766 | 0.78 | ALDH1A1 (0.55) | ALDH1A1HTTTSHRNPC1KDM4E | |
| SCHEMBL18153300 | 0.77 | MEN1 (0.51) | ALDH1A1HTTKDM4ERAB9AMAPT | |
| SCHEMBL446237 | 0.77 | MAPT (0.63) | ALDH1A1HTTTSHRNPC1KDM4E | |
| SCHEMBL17608965 | 0.77 | ALDH1A1 (0.51) | ALDH1A1HTTTSHRNPC1KDM4E | |
| SCHEMBL3407383 | 0.77 | ALDH1A1 (0.60) | ALDH1A1HTTTSHRNPC1KDM4E | |
| SCHEMBL19510873 | 0.77 | ALDH1A1 (0.57) | ALDH1A1HTTTSHRNPC1KDM4E | |
| SCHEMBL7902841 | 0.75 | ALDH1A1 (0.55) | ALDH1A1HTTTSHRNPC1RAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2257541-A1 | MODULATORS FOR AMYLOID BETA | F. Hoffmann-La Roche AG (CH) | 2010-12-08 | — | — | EP | disclosed |
| WO-2009103652-A1 | MODULATORS FOR AMYLOID BETA | F. HOFFMANN-LA ROCHE AG (CH) | 2009-08-27 | — | — | WO | disclosed |