Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NMBR | P28336 | 10/20 | 0.49 |
| ▸ | TACR1 | P25103 | 3/20 | 0.47 |
| ▸ | CTSL | P07711 | 2/20 | 0.47 |
| ▸ | CTSS | P25774 | 1/20 | 0.47 |
| ▸ | CTSK | P43235 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | MMP9 | P14780 | 1/20 | 0.45 |
| ▸ | MMP8 | P22894 | 1/20 | 0.45 |
| ▸ | MMP14 | P50281 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CCKBR | P32239 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL6020424 | 0.88 | NMBR (0.52) | NMBRTACR1CTSLCTSSCTSK | |
| SCHEMBL6019136 | 0.87 | NMBR (0.51) | NMBRTACR1CTSLCTSSCTSK | |
| SCHEMBL6020423 | 0.82 | CTSL (0.69) | NMBRTACR1CTSLCTSSCTSK | |
| SCHEMBL6019145 | 0.81 | NMBR (0.58) | NMBRTACR1CTSLCTSSCTSK | |
| SCHEMBL6471832 | 0.81 | NMBR (0.56) | NMBRTACR1CTSLCTSSCTSK | |
| SCHEMBL6019142 | 0.79 | NMBR (0.65) | NMBRTACR1CTSLCTSSCTSK | |
| SCHEMBL732867 | 0.76 | ALOX15 (0.59) | NMBRTACR1ALOX15 | |
| SCHEMBL6020520 | 0.76 | CCKBR (0.55) | NMBRTACR1CTSLCTSSCTSK | |
| SCHEMBL6020206 | 0.76 | NMBR (0.53) | NMBRCTSLCTSSCTSKKDM4E | |
| SCHEMBL6020369 | 0.75 | NMBR (0.65) | NMBRTACR1CTSLCTSSCTSK |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1575903-A1 | COMPOUNDS FOR THE INHIBITION OF ROTAMASES | Jerini AG (DE) | 2005-09-21 | — | — | EP | disclosed |
| WO-2004065353-A1 | COMPOUNDS FOR THE INHIBITION OF ROTAMASES | JERINI AG (DE) | 2004-08-05 | — | — | WO | disclosed |