Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HSPB1 | P04792 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 2/20 | 0.31 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7957913 | 0.84 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2LMNATP53CYP3A4 | |
| SCHEMBL7957722 | 0.84 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2LMNATP53CYP3A4 | |
| SCHEMBL7955324 | 0.83 | NT5E (0.43) | ALDH1A1SMN1; SMN2LMNANPC1RAB9A | |
| SCHEMBL6758197 | 0.82 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2LMNATP53CYP3A4 | |
| SCHEMBL7962155 | 0.77 | ALDH1A1 (0.34) | ALDH1A1SMN1; SMN2LMNATP53CYP3A4 | |
| SCHEMBL7957974 | 0.77 | ALDH1A1 (0.41) | ALDH1A1MAPTKDM4EHTT | |
| SCHEMBL6817377 | 0.77 | CA12 (0.37) | ALDH1A1SMN1; SMN2LMNATP53CYP3A4 | |
| SCHEMBL2021394 | 0.76 | HTT (0.45) | ALDH1A1SMN1; SMN2LMNATP53CYP3A4 | |
| SCHEMBL2021396 | 0.76 | HTT (0.45) | ALDH1A1SMN1; SMN2LMNATP53CYP3A4 | |
| SCHEMBL19718604 | 0.76 | HTT (0.45) | ALDH1A1SMN1; SMN2LMNATP53CYP3A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6271342-B1 | SERUM STABILITY; FOR TUMOR THERAPY | BAYER AKTIENGESELLSCHAFT (DE) | 2001-08-07 | — | — | US | disclosed |
| EP-0906313-A1 | CARBAPENEM ANTIBACTERIAL COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT | Merck & Co., Inc. (US) | 1999-04-07 | — | — | EP | disclosed |
| CN-1185786-A | Sugar-modified cytostatics | BAYER AG (DE) | 1998-06-24 | — | — | CN | disclosed |
| WO-1997040048-A1 | CARBAPENEM ANTIBACTERIAL COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT | MERCK & CO., INC. (US) | 1997-10-30 | — | — | WO | disclosed |