Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 7/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 5/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.39 |
| ▸ | NCOA1 | Q15788 | 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 | |
|---|---|---|---|---|
| SCHEMBL6090672 | 1.00 | TP53 (0.42) | TP53POLBHPGDALDH1A1NPSR1 | |
| SCHEMBL6088582 | 0.81 | NPSR1 (0.44) | TP53POLBHPGDALDH1A1NPSR1 | |
| SCHEMBL6088586 | 0.81 | NPSR1 (0.44) | TP53POLBHPGDALDH1A1NPSR1 | |
| SCHEMBL6093367 | 0.80 | ALK (0.41) | TP53NPSR1GAAALKABL1 | |
| SCHEMBL6093374 | 0.80 | ALK (0.41) | TP53NPSR1GAAALKABL1 | |
| SCHEMBL6091152 | 0.80 | KMT2A (0.43) | TP53POLBHPGDALDH1A1NPSR1 | |
| SCHEMBL6091158 | 0.80 | KMT2A (0.43) | TP53POLBHPGDALDH1A1NPSR1 | |
| SCHEMBL6091072 | 0.78 | ABL1 (0.39) | ALDH1A1KDM4EMAPTSMN1; SMN2ALK | |
| SCHEMBL6091068 | 0.78 | ABL1 (0.39) | ALDH1A1KDM4EMAPTSMN1; SMN2ALK | |
| SCHEMBL6090412 | 0.77 | KDR (0.53) | HPGDSMN1; SMN2ALKABL1RET |
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 |