Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.50 |
| ▸ | MAPT | P10636 | 11/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 6/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.47 |
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | THRB | P10828 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 3/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | CTSD | P07339 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.42 |
| ▸ | INSR | P06213 | 1/20 | 0.42 |
| ▸ | IGF1R | P08069 | 1/20 | 0.42 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.42 |
| ▸ | SRC | P12931 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL12846512 | 0.89 | SMN1; SMN2 (0.50) | SMN1; SMN2MAPTALDH1A1KDM4EGAA | |
| SCHEMBL4341725 | 0.85 | MAPT (0.52) | SMN1; SMN2MAPTALDH1A1KDM4EMEN1 | |
| SCHEMBL4502451 | 0.84 | MAPT (0.50) | SMN1; SMN2MAPTALDH1A1KDM4EGAA | |
| SCHEMBL4348872 | 0.82 | MEN1 (0.48) | SMN1; SMN2MAPTALDH1A1KDM4EGAA | |
| SCHEMBL4561504 | 0.80 | MAPT (0.54) | SMN1; SMN2MAPTALDH1A1KDM4EGAA | |
| SCHEMBL4354538 | 0.80 | SMN1; SMN2 (0.52) | SMN1; SMN2MAPTKDM4EGAAMEN1 | |
| SCHEMBL4352804 | 0.78 | MAPT (0.56) | SMN1; SMN2MAPTALDH1A1KDM4EGAA | |
| SCHEMBL6224490 | 0.77 | MAPT (0.44) | SMN1; SMN2MAPTALDH1A1KDM4EMEN1 | |
| SCHEMBL12846511 | 0.77 | SMN1; SMN2 (0.49) | SMN1; SMN2MAPTKDM4EMEN1KMT2A | |
| SCHEMBL4341723 | 0.76 | MAPT (0.49) | SMN1; SMN2MAPTKDM4EGAAMEN1 |
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-2100876-A2 | New compounds for the inhibition of rotamases and use thereof | Jerini AG (DE) | 2009-09-16 | — | — | EP | claimed |
| CN-1701061-A | Novel compounds for inhibiting rotamase enzymes and uses thereof | JERINI AG (DE) | 2005-11-23 | — | — | CN | claimed |
| EP-2100876-A2 | New compounds for the inhibition of rotamases and use thereof | Jerini AG (DE) | 2009-09-16 | — | — | EP | disclosed |