Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | MITF | O75030 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | CTSD | P07339 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 3/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.32 |
| ▸ | RECQL | P46063 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10583869 | 0.77 | TDP1 (0.43) | TDP1TSHRALDH1A1L3MBTL1LMNA | |
| SCHEMBL28336718 | 0.75 | MAPT (0.42) | TDP1TSHRALDH1A1L3MBTL1LMNA | |
| SCHEMBL4721887 | 0.74 | ALDH1A1 (0.36) | TDP1TSHRALDH1A1L3MBTL1LMNA | |
| SCHEMBL10584531 | 0.73 | TDP1 (0.40) | TDP1TSHRALDH1A1L3MBTL1LMNA | |
| SCHEMBL2255542 | 0.73 | TDP1 (0.48) | TDP1TSHRALDH1A1L3MBTL1LMNA | |
| SCHEMBL10697600 | 0.70 | TDP1 (0.44) | TDP1TSHRALDH1A1L3MBTL1LMNA | |
| SCHEMBL11065415 | 0.70 | TDP1 (0.44) | TDP1TSHRALDH1A1L3MBTL1LMNA | |
| SCHEMBL44951 | 0.69 | — | — | |
| SCHEMBL4654107 | 0.69 | ALDH1A1 (0.39) | TDP1TSHRALDH1A1L3MBTL1LMNA | |
| SCHEMBL34463716 | 0.69 | IDO1 (0.42) | TDP1TSHRALDH1A1L3MBTL1LMNA |
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-2245033-A1 | PYRROLOPYRAZINE KINASE INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2010-11-03 | — | — | EP | disclosed |
| WO-2009106441-A1 | PYRROLOPYRAZINE KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2009-09-03 | — | — | WO | disclosed |