Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.45 |
| ▸ | CDK2 | P24941 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | DHODH | Q02127 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 5/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.39 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL6771481 | 0.87 | OPRM1 (0.43) | HIF1ASMN1; SMN2ALDH1A1CCNA2CDK2 | |
| SCHEMBL6770476 | 0.87 | OPRM1 (0.45) | HIF1ASMN1; SMN2ALDH1A1DHODHOPRM1 | |
| SCHEMBL6769819 | 0.87 | OPRM1 (0.43) | SMN1; SMN2ALDH1A1MEN1KMT2ADHODH | |
| SCHEMBL6164547 | 0.86 | DHODH (0.43) | HIF1ASMN1; SMN2ALDH1A1CCNA2CDK2 | |
| SCHEMBL6770505 | 0.86 | OPRM1 (0.46) | SMN1; SMN2MEN1KMT2ADHODHOPRM1 | |
| SCHEMBL6168419 | 0.85 | DHODH (0.42) | HIF1ASMN1; SMN2ALDH1A1CCNA2CDK2 | |
| SCHEMBL6164978 | 0.84 | DHODH (0.41) | HIF1ASMN1; SMN2ALDH1A1CCNA2CDK2 | |
| SCHEMBL6162163 | 0.83 | DHODH (0.41) | HIF1ASMN1; SMN2ALDH1A1CCNA2CDK2 | |
| SCHEMBL6167870 | 0.82 | ALDH1A1 (0.49) | HIF1ASMN1; SMN2ALDH1A1CCNA2CDK2 | |
| SCHEMBL6165346 | 0.82 | ALDH1A1 (0.40) | HIF1ASMN1; SMN2ALDH1A1CCNA2CDK2 |
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-1177185-B1 | 4, 5, 6, 7-TETRAHYDROINDAZOLE DERIVATIVES AS ANTITUMOR AGENTS | PHARMACIA ITALIA SPA (IT) | 2005-04-20 | — | — | EP | disclosed |
| US-6716856-B1 | CELL PROLIFERATIVE DISORDERS OR ALZHEIMER'S DISEASE; REDUCED TOXICITY; CDK/CYCLIN KINASE INHIBITORY ACTIVITY | PHARMACIA & TUBJOHN SPA (IT) | 2004-04-06 | — | — | US | disclosed |