Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 8/20 | 0.56 |
| ▸ | ACHE | P22303 | 8/20 | 0.56 |
| ▸ | BCHE | P06276 | 6/20 | 0.56 |
| ▸ | TYR | P14679 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.37 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL895976 | 0.90 | PTGS2 (0.62) | PTGS2ACHEBCHETYRNPC1 | |
| SCHEMBL5796025 | 0.86 | PTGS2 (0.51) | PTGS2ACHEBCHENPC1RAB9A | |
| Ethylene SCHEMBL8585970 | 0.86 | TYR (0.46) | PTGS2ACHEBCHETYRALDH1A3 | |
| SCHEMBL6200956 | 0.82 | TYR (0.67) | TYRALDH1A3ALDH1A1ALDH3A1GRIA4 | |
| SCHEMBL2047680 | 0.81 | PTGS2 (0.53) | PTGS2ACHEBCHETYRNPC1 | |
| SCHEMBL6286470 | 0.80 | TYR (0.48) | PTGS2ACHEBCHETYRALDH1A3 | |
| SCHEMBL9944620 | 0.78 | TYR (0.55) | PTGS2ACHEBCHETYRALDH1A3 | |
| SCHEMBL9228346 | 0.78 | TYR (0.55) | TYRRAB9AALDH1A3ALDH1A1ALDH3A1 | |
| SCHEMBL15145397 | 0.75 | PTGS2 (0.57) | PTGS2ACHEBCHENPC1RAB9A | |
| SCHEMBL6394314 | 0.74 | PTGS2 (0.57) | PTGS2ACHEBCHENPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991003474-A1 | HYPOGLYCEMIC THIAZOLIDINEDIONE DERIVATIVES | PFIZER INC. (US) | 1991-03-21 | — | — | WO | disclosed |
| WO-1989008651-A1 | HYPOGLYCEMIC THIAZOLIDINEDIONE DERIVATIVES | PFIZER INC. (US) | 1989-09-21 | — | — | WO | disclosed |