Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 4/20 | 0.45 |
| ▸ | HTT | P42858 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CASR | P41180 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4341979 | 0.87 | POLB (0.54) | POLBHTTKMT2AMEN1MAPT | |
| SCHEMBL4359277 | 0.86 | HTT (0.51) | POLBHTTKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL4343912 | 0.85 | HTT (0.47) | POLBHTTKMT2AMEN1MAPT | |
| SCHEMBL28754296 | 0.82 | POLB (0.39) | POLBHTTKMT2AMEN1MAPT | |
| SCHEMBL4344549 | 0.81 | POLB (0.48) | POLBHTTKMT2AMEN1MAPT | |
| SCHEMBL4345572 | 0.81 | KMT2A (0.41) | POLBHTTKMT2AMEN1MAPT | |
| SCHEMBL4344547 | 0.79 | POLB (0.46) | POLBHTTKMT2AMEN1MAPT | |
| SCHEMBL6526431 | 0.79 | HTT (0.47) | POLBHTTKMT2AMEN1MAPT | |
| SCHEMBL6520461 | 0.77 | POLB (0.40) | POLBHTTKMT2AMEN1MAPT | |
| SCHEMBL4342251 | 0.76 | POLB (0.39) | POLBHTTKMT2AMEN1MAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100546977-C | Suppress the new compound and the application thereof of rotamase | JERINI AG (DE) | 2009-10-07 | — | — | CN | claimed |
| 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 |