Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.61 |
| ▸ | HPGD | P15428 | 2/20 | 0.61 |
| ▸ | CES2 | O00748 | 1/20 | 0.52 |
| ▸ | CES1 | P23141 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 5/20 | 0.50 |
| ▸ | CA2 | P00918 | 5/20 | 0.50 |
| ▸ | PDE4A | P27815 | 1/20 | 0.50 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.50 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.50 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA7 | P43166 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | GSK3B | P49841 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL6937356 | 0.81 | ALDH1A1 (0.65) | MAPTALDH1A1KDM4EHPGDCES2 | |
| SCHEMBL9815845 | 0.81 | ALDH1A1 (0.65) | MAPTALDH1A1KDM4EHPGDCES2 | |
| SCHEMBL1120697 | 0.80 | NQO2 (0.56) | MAPTALDH1A1KDM4EHPGDCES2 | |
| SCHEMBL28251903 | 0.80 | CES2 (0.50) | MAPTALDH1A1KDM4EHPGDCES2 | |
| SCHEMBL989932 | 0.80 | NQO2 (0.56) | MAPTALDH1A1KDM4EHPGDCES2 | |
| SCHEMBL28251902 | 0.80 | CES2 (0.50) | MAPTALDH1A1KDM4EHPGDCES2 | |
| SCHEMBL23259346 | 0.79 | ALDH1A1 (0.63) | MAPTALDH1A1KDM4EHPGDCES2 | |
| Ammonia Solution, Strong SCHEMBL5700298 | 0.79 | ALDH1A1 (0.63) | MAPTALDH1A1KDM4EHPGDCES2 | |
| SCHEMBL8271268 | 0.77 | ALDH1A1 (0.61) | MAPTALDH1A1KDM4EHPGDCES2 | |
| SCHEMBL9839256 | 0.76 | ALDH1A1 (1.00) | MAPTALDH1A1KDM4EHPGDCES2 |
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-0651024-B1 | Method of producing polymethine dyes | MINNESOTA MINING & MFG (US) | 1996-08-14 | — | — | EP | disclosed |
| EP-0651024-A1 | Method of producing polymethine dyes | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1995-05-03 | — | — | EP | disclosed |
| US-5386058-A | Method of producing polymethine dyes | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1995-01-31 | — | — | US | disclosed |