Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | PLG | P00747 | 1/20 | 0.40 |
| ▸ | PLAU | P00749 | 1/20 | 0.40 |
| ▸ | PLAT | P00750 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | KIF18A | Q8NI77 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA3 | P07451 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5035106 | 0.85 | MAPK1 (0.53) | ALDH1A1L3MBTL1KDM4ELMNAPOLB | |
| SCHEMBL5032646 | 0.82 | KDM4E (0.54) | ALDH1A1L3MBTL1KDM4ETHRBLMNA | |
| SCHEMBL5035886 | 0.76 | THRB (0.64) | ALDH1A1L3MBTL1KDM4ETHRB | |
| SCHEMBL5032668 | 0.76 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1KDM4ELMNANPC1 | |
| SCHEMBL30079307 | 0.75 | TSHR (0.63) | ALDH1A1L3MBTL1KDM4ETSHRSMN1; SMN2 | |
| SCHEMBL13684651 | 0.74 | PKM (0.46) | ALDH1A1KDM4ETHRBLMNANPC1 | |
| SCHEMBL1940129 | 0.74 | KDM4E (0.37) | ALDH1A1L3MBTL1KDM4EPOLBCA12 | |
| SCHEMBL13545096 | 0.73 | SMN1; SMN2 (0.47) | ALDH1A1KDM4ETHRBLMNANPC1 | |
| SCHEMBL3524423 | 0.73 | LMNA (0.62) | ALDH1A1KDM4EHTTLMNANPC1 | |
| SCHEMBL5034910 | 0.72 | KDM4E (0.56) | ALDH1A1L3MBTL1KDM4EHTTLMNA |
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-1761541-B1 | PYRRAZOLO-PYRIMIDINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2008-01-09 | — | — | EP | claimed |
| EP-1761541-B1 | PYRRAZOLO-PYRIMIDINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2008-01-09 | — | — | EP | disclosed |