Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | HAAO | P46952 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.43 |
| ▸ | DHFR | P00374 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MPO | P05164 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL242262 | 0.98 | CYP1A2 (0.48) | CYP1A2HAAOALDH1A1KDM4EHPGD | |
| SCHEMBL29370019 | 0.98 | CYP1A2 (0.48) | CYP1A2HAAOALDH1A1KDM4EHPGD | |
| SCHEMBL28033212 | 0.98 | CYP1A2 (0.48) | CYP1A2HAAOALDH1A1KDM4EHPGD | |
| SCHEMBL6914735 | 0.95 | CYP1A2 (0.46) | CYP1A2HAAOALDH1A1KDM4EHPGD | |
| SCHEMBL6913856 | 0.95 | CYP1A2 (0.46) | CYP1A2HAAOALDH1A1KDM4EHPGD | |
| SCHEMBL6909275 | 0.95 | CYP1A2 (0.46) | CYP1A2HAAOALDH1A1KDM4EHPGD | |
| Methane SCHEMBL28422886 | 0.95 | CYP1A2 (0.46) | CYP1A2HAAOALDH1A1KDM4EHPGD | |
| SCHEMBL6915142 | 0.95 | CYP1A2 (0.46) | CYP1A2HAAOALDH1A1KDM4EHPGD | |
| SCHEMBL6908109 | 0.95 | CYP1A2 (0.46) | CYP1A2HAAOALDH1A1KDM4EHPGD | |
| SCHEMBL6913994 | 0.95 | CYP1A2 (0.46) | CYP1A2HAAOALDH1A1KDM4EHPGD |
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-6830704-B2 | Contains a Lewis acid metal salt and a compound having clathrating ability. | TOAGOSEI CO., LTD. (JP) | 2004-12-14 | — | — | US | disclosed |
| US-20030135016-A1 | Contains a Lewis acid metal salt and a compound having clathrating ability. | TOAGOSEI CO., LTD. | 2003-07-17 | — | — | US | disclosed |
| US-6547985-B1 | Adhesive mixture | TOGOSEI CO., LTD. (JP) | 2003-04-15 | — | — | US | disclosed |