Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.39 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CA7 | P43166 | 3/20 | 0.39 |
| ▸ | CA9 | Q16790 | 3/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.35 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | TYR | P14679 | 1/20 | 0.34 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6091331 | 1.00 | CA12 (0.39) | CA12CA1CA2CA7CA9 | |
| SCHEMBL6090270 | 0.91 | LMNA (0.40) | PARP1MAPTSMN1; SMN2KDM4EGAA | |
| SCHEMBL6090279 | 0.91 | LMNA (0.40) | PARP1MAPTSMN1; SMN2KDM4EGAA | |
| SCHEMBL6090324 | 0.91 | MAPT (0.38) | ALOX5MAPTSMN1; SMN2GAAALDH1A1 | |
| SCHEMBL6090321 | 0.91 | MAPT (0.38) | ALOX5MAPTSMN1; SMN2GAAALDH1A1 | |
| SCHEMBL6091985 | 0.81 | JAK2 (0.38) | CA12CA1CA2CA7CA9 | |
| SCHEMBL6091976 | 0.81 | JAK2 (0.38) | CA12CA1CA2CA7CA9 | |
| SCHEMBL6089530 | 0.79 | PDPK1 (0.34) | ESR1ESR2PDPK1 | |
| SCHEMBL6089536 | 0.79 | PDPK1 (0.34) | ESR1ESR2PDPK1 | |
| SCHEMBL6090145 | 0.79 | PDPK1 (0.34) | ESR1ESR2PDPK1HTTKDR |
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 |