Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.56 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.51 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.51 |
| ▸ | BACE1 | P56817 | 1/20 | 0.49 |
| ▸ | CTSK | P43235 | 1/20 | 0.47 |
| ▸ | PPARG | P37231 | 1/20 | 0.46 |
| ▸ | PPARA | Q07869 | 1/20 | 0.46 |
| ▸ | BCHE | P06276 | 1/20 | 0.45 |
| ▸ | PTGES | O14684 | 1/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5868933 | 1.00 | ACHE (0.56) | ACHEAKR1C3AKR1C2BACE1CTSK | |
| SCHEMBL5869164 | 0.99 | ACHE (0.55) | ACHEAKR1C3AKR1C2BACE1CTSK | |
| SCHEMBL5870078 | 0.85 | BACE1 (0.49) | ACHEBACE1CTSKPPARGPPARA | |
| SCHEMBL12702676 | 0.85 | BACE1 (0.56) | ACHEAKR1C3AKR1C2BACE1PPARG | |
| SCHEMBL8019435 | 0.84 | BACE1 (0.58) | ACHEAKR1C3AKR1C2BACE1PPARG | |
| SCHEMBL868605 | 0.83 | ACHE (0.63) | ACHEAKR1C3AKR1C2PPARGPPARA | |
| SCHEMBL3079265 | 0.83 | ACHE (0.63) | ACHEAKR1C3AKR1C2PPARGPPARA | |
| SCHEMBL868603 | 0.83 | ACHE (0.63) | ACHEAKR1C3AKR1C2PPARGPPARA | |
| SCHEMBL7886365 | 0.80 | BACE1 (0.56) | ACHEAKR1C3AKR1C2BACE1PPARG | |
| SCHEMBL30978008 | 0.80 | APP (0.55) | BACE1PTGESALOX5PTGS1PTGS2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20040176311-A1 | Composition and method for treating cancer | MO HUANBIAO (US) | 2004-09-09 | — | — | US | claimed |
| US-7074825-B2 | Composition and method for treating cancer | MO HUANBIAO | 2006-07-11 | — | — | US | disclosed |
| US-20040176311-A1 | Composition and method for treating cancer | MO HUANBIAO (US) | 2004-09-09 | — | — | US | disclosed |