Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 3/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.56 |
| ▸ | PKM | P14618 | 1/20 | 0.56 |
| ▸ | MAOB | P27338 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 5/20 | 0.52 |
| ▸ | MAPT | P10636 | 5/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 5/20 | 0.51 |
| ▸ | AKR1C1 | Q04828 | 3/20 | 0.50 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | FBP1 | P09467 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6168237 | 1.00 | AKR1C3 (0.59) | AKR1C3KMT2AKDM4EALDH1A1POLB | |
| SCHEMBL5183481 | 0.83 | AKR1C1 (0.70) | AKR1C3KMT2AKDM4EALDH1A1POLB | |
| SCHEMBL7992874 | 0.83 | AKR1C1 (0.70) | AKR1C3KMT2AKDM4EALDH1A1POLB | |
| SCHEMBL6172379 | 0.83 | AKR1C1 (0.70) | AKR1C3KMT2AKDM4EALDH1A1POLB | |
| SCHEMBL6169410 | 0.82 | ALDH1A1 (0.55) | AKR1C3KMT2AKDM4EALDH1A1POLB | |
| SCHEMBL6169411 | 0.82 | ALDH1A1 (0.55) | AKR1C3KMT2AKDM4EALDH1A1POLB | |
| SCHEMBL11079773 | 0.82 | HTT (0.55) | AKR1C3KMT2AKDM4EALDH1A1POLB | |
| SCHEMBL11079768 | 0.82 | HTT (0.55) | AKR1C3KMT2AKDM4EALDH1A1POLB | |
| SCHEMBL6176859 | 0.82 | AKR1C3 (0.50) | AKR1C3KMT2AKDM4EALDH1A1POLB | |
| SCHEMBL6176863 | 0.82 | AKR1C3 (0.50) | AKR1C3KMT2AKDM4EALDH1A1POLB |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1528059-A2 | Substituted isoxazoles for the treatment of inflammation | G.D. Searle LLC (US) | 2005-05-04 | — | — | EP | disclosed |
| EP-0809636-B1 | SUBSTITUTED ISOXAZOLES FOR THE TREATMENT OF INFLAMMATION | SEARLE & CO (US) | 2002-09-04 | — | — | EP | disclosed |
| EP-1223167-A2 | Substituted isoxazoles for the treatment of inflammation | G.D. Searle & Co. (US) | 2002-07-17 | — | — | EP | disclosed |
| US-5859257-A | ANTIINFLAMMATORY, ANTIARTHRITIC AGENTS | G. D. SEARLE & CO. (US) | 1999-01-12 | — | — | US | disclosed |
| US-4791122-A | HYPOTENSIVE AGENTS, ANTIARRHYTHMIA AGENTS | BAYER AKTIENGESELLSCHAFT (DE) | 1988-12-13 | — | — | US | disclosed |