Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MMP3 | P08254 | 1/20 | 0.30 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL639800 | 1.00 | ALDH1A1 (0.32) | ALDH1A1MMP3BCL2L1 | |
| SCHEMBL639799 | 1.00 | ALDH1A1 (0.32) | ALDH1A1MMP3BCL2L1 | |
| SCHEMBL639798 | 1.00 | ALDH1A1 (0.32) | ALDH1A1MMP3BCL2L1 | |
| SCHEMBL9788612 | 0.82 | ESR1 (0.39) | ALDH1A1MMP3BCL2L1 | |
| SCHEMBL2931007 | 0.80 | CYP1A2 (0.32) | — | |
| SCHEMBL6744628 | 0.72 | KDM4E (0.43) | ALDH1A1 | |
| SCHEMBL16807414 | 0.68 | ADAMTS4 (0.37) | ALDH1A1 | |
| SCHEMBL28153377 | 0.67 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL11237308 | 0.65 | BACE1 (0.32) | ALDH1A1 | |
| SCHEMBL30139970 | 0.65 | CYP3A4 (0.33) | ALDH1A1 |
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-1373889-A2 | BIOSENSORS, REAGENTS AND DIAGNOSTIC APPLICATIONS OF DIRECTED EVOLUTION | Maxygen, Inc. (US) | 2004-01-02 | — | — | EP | disclosed |
| WO-2002010750-A2 | BIOSENSORS, REAGENTS AND DIAGNOSTIC APPLICATIONS OF DIRECTED EVOLUTION | MAXYGEN, INC. (US) | 2002-02-07 | — | — | WO | disclosed |
| WO-1999050259-A2 | SYNTHESIS OF POLYSUBSTITUTED AROMATIC COMPOUNDS AND AROMATISATION PROCESS FOR USE THEREIN | WHITE KNIGHT BIOTECHNOLOGIES LIMITED (GB) | 1999-10-07 | — | — | WO | disclosed |