Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 6/20 | 0.53 |
| ▸ | AKR1C2 | P52895 | 6/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.44 |
| ▸ | APP | P05067 | 3/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.42 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.42 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.42 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.42 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.42 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.42 |
| ▸ | FABP2 | P12104 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL14465122 | 0.87 | AKR1C3 (0.68) | AKR1C3AKR1C2PTGS2APPPTGS1 | |
| SCHEMBL31240211 | 0.87 | AKR1C3 (0.68) | AKR1C3AKR1C2PTGS2APPPTGS1 | |
| SCHEMBL27711084 | 0.82 | TDP1 (0.44) | AKR1C3AKR1C2PTGS2PTGS1LMNA | |
| SCHEMBL27852035 | 0.79 | APP (0.42) | AKR1C3AKR1C2PTGS2APPPTGS1 | |
| SCHEMBL27760488 | 0.79 | APP (0.49) | AKR1C3AKR1C2PTGS2APPPTGS1 | |
| SCHEMBL28017128 | 0.78 | TP53 (0.45) | AKR1C3AKR1C2PTGS1CYP2C9CYP2C19 | |
| SCHEMBL8251464 | 0.78 | UGT2B7 (0.45) | AKR1C3AKR1C2PTGS1LMNAMEN1 | |
| SCHEMBL8272795 | 0.77 | AKR1C3 (0.40) | AKR1C3AKR1C2PTGS2PTGS1LMNA | |
| SCHEMBL84446 | 0.77 | LMNA (0.52) | AKR1C3AKR1C2PTGS2PTGS1LMNA | |
| SCHEMBL18252778 | 0.77 | AKR1C3 (0.49) | AKR1C3AKR1C2PTGS2APPPTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102822168-B | Method for producing isoxazoline derivatives | 先正达参股股份有限公司 | 2016-10-26 | — | — | CN | disclosed |
| CN-102822168-A | Method for producing isoxazoline derivatives | SYNGENTA PARTICIPATIONS AG | 2012-12-12 | — | — | CN | disclosed |
| CN-101627007-A | Aminoamides as orexin antagonists | HOFFMANN LA ROCHE | 2010-01-13 | — | — | CN | disclosed |