Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.59 |
| ▸ | MAPT | P10636 | 4/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.59 |
| ▸ | LMNA | P02545 | 3/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.59 |
| ▸ | HTT | P42858 | 2/20 | 0.59 |
| ▸ | NPC1 | O15118 | 2/20 | 0.59 |
| ▸ | RAB9A | P51151 | 2/20 | 0.59 |
| ▸ | GAA | P10253 | 1/20 | 0.59 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.58 |
| ▸ | MYOC | Q99972 | 1/20 | 0.58 |
| ▸ | CA12 | O43570 | 5/20 | 0.57 |
| ▸ | CA2 | P00918 | 5/20 | 0.57 |
| ▸ | CA9 | Q16790 | 5/20 | 0.57 |
| ▸ | CA1 | P00915 | 4/20 | 0.57 |
| ▸ | CXCR2 | P25025 | 4/20 | 0.51 |
| ▸ | CXCR1 | P25024 | 3/20 | 0.51 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.49 |
| ▸ | PNLIP | P16233 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL6691053 | 0.99 | MEN1 (0.61) | MEN1MAPTKMT2ALMNAMAPK1 | |
| SCHEMBL4341820 | 0.89 | MAPT (0.72) | MEN1MAPTKMT2ALMNAMAPK1 | |
| SCHEMBL6712125 | 0.86 | MEN1 (0.81) | MEN1MAPTKMT2ALMNAMAPK1 | |
| SCHEMBL6691056 | 0.82 | FFAR1 (0.47) | MEN1MAPTKMT2ALMNAMAPK1 | |
| SCHEMBL1602832 | 0.82 | MAPK1 (0.51) | MEN1MAPTKMT2ALMNAMAPK1 | |
| SCHEMBL4351078 | 0.81 | MEN1 (0.67) | MEN1MAPTKMT2ALMNAMAPK1 | |
| SCHEMBL4342380 | 0.81 | CA12 (0.64) | MEN1MAPTKMT2ALMNAMAPK1 | |
| SCHEMBL11027238 | 0.81 | MEN1 (0.88) | MEN1MAPTKMT2ALMNAMAPK1 | |
| SCHEMBL4356349 | 0.80 | MEN1 (0.62) | MEN1MAPTKMT2ALMNAMAPK1 | |
| SCHEMBL5594982 | 0.79 | CXCR2 (0.79) | MEN1MAPTKMT2ALMNAMAPK1 |
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 |