Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 1/20 | 0.41 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.40 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.40 |
| ▸ | HSD17B4 | P51659 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.36 |
| ▸ | JAK3 | P52333 | 4/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | NPY5R | Q15761 | 3/20 | 0.35 |
| ▸ | BTK | Q06187 | 1/20 | 0.34 |
| ▸ | TYMP | P19971 | 1/20 | 0.33 |
| ▸ | ERN1 | O75460 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL6090385 | 1.00 | ALK (0.41) | ALKHSD17B1HSD17B2HSD17B4KDR | |
| SCHEMBL6090988 | 0.82 | KDR (0.49) | ALKKDRALDH1A1LMNAPDE3B | |
| SCHEMBL6090995 | 0.82 | KDR (0.49) | ALKKDRALDH1A1LMNAPDE3B | |
| SCHEMBL6089687 | 0.82 | KDR (0.54) | KDR | |
| SCHEMBL6089692 | 0.82 | KDR (0.54) | KDR | |
| SCHEMBL6102271 | 0.77 | JAK3 (0.57) | ALKKDRALDH1A1LMNAJAK3 | |
| SCHEMBL6102265 | 0.77 | JAK3 (0.57) | ALKKDRALDH1A1LMNAJAK3 | |
| SCHEMBL6091863 | 0.76 | KDR (0.31) | KDR | |
| SCHEMBL6091867 | 0.76 | KDR (0.31) | KDR | |
| SCHEMBL6093034 | 0.76 | ALK (0.40) | ALKKDRALDH1A1LMNAHPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7060822-B1 | 2-pyrazolin-5-ones | ABBOTT GMBH & CO. KG (DE) | 2006-06-13 | — | — | US | disclosed |