Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 3/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | PIM3 | Q86V86 | 3/20 | 0.43 |
| ▸ | ERN1 | O75460 | 1/20 | 0.40 |
| ▸ | METAP2 | P50579 | 1/20 | 0.38 |
| ▸ | PIM1 | P11309 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CDK1 | P06493 | 2/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.34 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.34 |
| ▸ | GSK3A | P49840 | 1/20 | 0.34 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.34 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29954657 | 0.88 | LMNA (0.44) | GSK3BCYP2A6PIM3ERN1PIM1 | |
| SCHEMBL22128321 | 0.79 | GSK3B (0.51) | GSK3BCYP2A6PIM3ERN1METAP2 | |
| SCHEMBL29952323 | 0.76 | GSK3B (0.51) | GSK3BCYP2A6PIM3ERN1METAP2 | |
| SCHEMBL21958141 | 0.71 | GSK3B (0.47) | GSK3BCYP2A6PIM3ERN1 | |
| SCHEMBL22346720 | 0.71 | ALOX15 (0.53) | GSK3BCYP2A6PIM3PIM1PIM2 | |
| SCHEMBL14796629 | 0.69 | GSK3B (0.45) | GSK3BCYP2A6PIM3ERN1METAP2 | |
| SCHEMBL29952744 | 0.69 | CYP2A6 (0.44) | CYP2A6PIM3ERN1PIM1CDK1 | |
| SCHEMBL4323256 | 0.69 | GSK3B (0.51) | GSK3BCYP2A6PIM3ERN1CDK1 | |
| SCHEMBL29955347 | 0.68 | ALOX15 (0.73) | GSK3BHPGD | |
| Ethane SCHEMBL29122859 | 0.67 | METAP2 (0.48) | GSK3BCYP2A6PIM3METAP2CDK1 |
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-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |