Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | MYC | P01106 | 2/20 | 0.33 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.31 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | CTSB | P07858 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4757311 | 0.81 | TSHR (0.37) | ALDH1A1NOTUMTSHRLMNAPDK1 | |
| SCHEMBL4814956 | 0.75 | ALDH1A1 (0.32) | ALDH1A1MYCNR4A1SMN1; SMN2PKM | |
| SCHEMBL4826843 | 0.69 | HCAR3 (0.39) | HCAR2ALDH1A1HTTMYCNR4A1 | |
| SCHEMBL4757320 | 0.67 | HCAR2 (0.39) | HCAR2ALDH1A1TP53NOTUMHTT | |
| SCHEMBL4757323 | 0.62 | SMN1; SMN2 (0.40) | HCAR2ALDH1A1TP53NOTUMHTT | |
| SCHEMBL4758286 | 0.59 | TSHR (0.36) | HCAR2ALDH1A1TP53NOTUMHTT | |
| SCHEMBL4758043 | 0.58 | CRHBP (0.40) | ALDH1A1TP53NOTUMHTTSMN1; SMN2 | |
| SCHEMBL224469 | 0.56 | ALDH1A1 (1.00) | ALDH1A1TP53NOTUMMYCNR4A1 | |
| Acetic Acid SCHEMBL27374496 | 0.56 | TP53 (0.67) | ALDH1A1TP53HTTTSHRCASP1 | |
| SCHEMBL6584266 | 0.55 | ALDH1A1 (0.95) | ALDH1A1TP53NOTUMMYCNR4A1 |
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-1858325-A2 | COMPOUNDS FOR INHIBITING BETA-AMYLOID PRODUCTION AND METHODS OF IDENTIFYING THE COMPOUNDS | Roskamp Research LLC (US) | 2007-11-28 | — | — | EP | disclosed |
| WO-2006074419-A2 | COMPOUNDS FOR INHIBITING BETA-AMYLOID PRODUCTION AND METHODS OF IDENTIFYING THE COMPOUNDS | ROSKAMP RESEARCH LLC (US) | 2006-07-13 | — | — | WO | disclosed |