Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 5/20 | 0.61 |
| ▸ | MAPT | P10636 | 5/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | GAA | P10253 | 2/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | MYC | P01106 | 1/20 | 0.60 |
| ▸ | MAX | P61244 | 1/20 | 0.60 |
| ▸ | HPGD | P15428 | 3/20 | 0.55 |
| ▸ | LMNA | P02545 | 3/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 3/20 | 0.54 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.48 |
| ▸ | BLM | P54132 | 1/20 | 0.48 |
| ▸ | CDK1 | P06493 | 1/20 | 0.48 |
| ▸ | MTOR | P42345 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4341860 | 0.85 | MEN1 (0.63) | MEN1MAPTKMT2AALDH1A1GAA | |
| SCHEMBL4357497 | 0.84 | MEN1 (0.61) | MEN1MAPTKMT2AALDH1A1GAA | |
| SCHEMBL4350068 | 0.84 | MTOR (0.67) | MEN1KMT2ASMN1; SMN2LMNAMTOR | |
| SCHEMBL4353864 | 0.83 | CDK1 (0.51) | MEN1MAPTKMT2AALDH1A1GAA | |
| SCHEMBL4345433 | 0.82 | MAOB (0.66) | MEN1MAPTKMT2AALDH1A1GAA | |
| SCHEMBL28034498 | 0.79 | MAPT (0.89) | MEN1MAPTKMT2AALDH1A1GAA | |
| SCHEMBL4354013 | 0.78 | MEN1 (0.64) | MEN1MAPTKMT2AALDH1A1GAA | |
| SCHEMBL4354452 | 0.78 | MEN1 (0.50) | MEN1MAPTKMT2AALDH1A1GAA | |
| SCHEMBL4357659 | 0.77 | MAPT (0.62) | MEN1MAPTKMT2AALDH1A1GAA | |
| SCHEMBL3298774 | 0.77 | ALDH1A1 (0.78) | MEN1MAPTKMT2AALDH1A1GAA |
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 |