Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPID | Q08752 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | ANPEP | P15144 | 2/20 | 0.46 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | FPR2 | P25090 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4343965 | 0.87 | CA12 (0.51) | PPIDMAPK1ANPEPCA12CA1 | |
| SCHEMBL4348746 | 0.85 | PPID (0.48) | PPIDANPEPCA12CA1CA2 | |
| SCHEMBL4342074 | 0.84 | ANPEP (0.46) | PPIDMAPK1ANPEPSMN1; SMN2 | |
| SCHEMBL12846671 | 0.81 | ANPEP (0.46) | PPIDMAPK1ANPEPSMN1; SMN2 | |
| SCHEMBL4346937 | 0.81 | FPR2 (0.59) | CA12CA1CA2CA9FPR2 | |
| SCHEMBL4348009 | 0.81 | ANPEP (0.46) | PPIDMAPK1ANPEPSMN1; SMN2 | |
| SCHEMBL12846496 | 0.80 | ANPEP (0.58) | PPIDANPEPSMN1; SMN2 | |
| SCHEMBL4358213 | 0.80 | ANPEP (0.58) | PPIDANPEPSMN1; SMN2 | |
| SCHEMBL7305420 | 0.79 | CTSL (0.56) | PPIDMAPK1ANPEPCA12CA1 | |
| SCHEMBL4347413 | 0.77 | FOLH1 (0.54) | PPIDMAPK1ANPEPCA12CA1 |
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 5 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-1402887-A1 | New compounds for the inhibition of undesired cell proliferation and use thereof | Jerini AG (DE) | 2004-03-31 | — | — | EP | claimed |
| EP-1402888-A1 | The use of substituted carbocyclic compounds as rotamases inhibitors | Jerini AG (DE) | 2004-03-31 | — | — | EP | claimed |
| EP-2100876-A2 | New compounds for the inhibition of rotamases and use thereof | Jerini AG (DE) | 2009-09-16 | — | — | EP | disclosed |