Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.44 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.44 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | UTS2R | Q9UKP6 | 9/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | UBE2N | P61088 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Xenbucin SCHEMBL24134 | 0.86 | PTGS2 (0.58) | PTGS2AKR1C3AKR1C2KCNQ2MAPT | |
| Xenbucin SCHEMBL3360074 | 0.83 | PTGS2 (0.55) | PTGS2AKR1C3AKR1C2KCNQ2MAPT | |
| Xenbucin SCHEMBL10345475 | 0.82 | PTGS2 (0.51) | PTGS2AKR1C3AKR1C2KCNQ2MAPT | |
| SCHEMBL10345478 | 0.79 | CHRM1 (0.63) | UTS2RKDM4EALDH1A1 | |
| SCHEMBL67237 | 0.76 | LMNA (0.59) | KCNQ2MAPTALDH1A1HTR1AADRA1A | |
| SCHEMBL65737 | 0.76 | LMNA (0.59) | KCNQ2MAPTALDH1A1HTR1AADRA1A | |
| SCHEMBL1715 | 0.76 | LMNA (0.59) | KCNQ2MAPTALDH1A1HTR1AADRA1A | |
| SCHEMBL29757088 | 0.76 | LMNA (0.59) | KCNQ2MAPTALDH1A1HTR1AADRA1A | |
| SCHEMBL20769804 | 0.76 | LMNA (0.59) | KCNQ2MAPTALDH1A1HTR1AADRA1A | |
| SCHEMBL1574429 | 0.76 | AKR1C3 (0.58) | PTGS2AKR1C3AKR1C2ALDH1A1HTR1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0105635-B1 | NONIRRITATING AQUEOUS OPHTHALMIC COMPOSITIONS COMFORT FORMULATION FOR OCULAR THEREPEUTIC AGENTS | ALCON LABORATORIES, INC. (US) | 1990-04-04 | — | — | EP | disclosed |
| US-4559343-A | ANTIINFLAMMATORY AGENT WITH XANTHINE DERIVATIVE | ALCON LABORATORIES, INC. (US) | 1985-12-17 | — | — | US | disclosed |
| EP-0105635-A2 | Nonirritating aqueous ophthalmic compositions comfort formulation for ocular therepeutic agents | ALCON LABORATORIES, INC. (US) | 1984-04-18 | — | — | EP | disclosed |