Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 1/20 | 0.41 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NR4A2 | P43354 | 7/20 | 0.38 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.37 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.35 |
| ▸ | ERN1 | O75460 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29958544 | 0.82 | KDM4E (0.39) | ALDH1A1CYP1A2CYP2C19MAPTKDM4E | |
| SCHEMBL30829502 | 0.81 | NR4A2 (0.43) | ALDH1A1CYP1A2CYP2C19PTGER4MAPT | |
| SCHEMBL15687368 | 0.78 | PIM3 (0.51) | PIM1PIM3ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL29953009 | 0.76 | ALDH1A1 (0.49) | ALDH1A1CYP1A2CYP2C19MAPTKDM4E | |
| SCHEMBL3035666 | 0.76 | ALDH1A1 (0.49) | ALDH1A1CYP1A2CYP2C19MAPTKDM4E | |
| SCHEMBL29957479 | 0.73 | CYP2A6 (0.42) | PIM1PIM3ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL30836700 | 0.73 | MAPK1 (0.43) | ALDH1A1CYP1A2CYP2C19PTGER4MAPT | |
| SCHEMBL29951048 | 0.73 | CYP2A6 (0.42) | PIM3ALDH1A1CYP1A2CYP2C19MAPT | |
| SCHEMBL23724874 | 0.72 | MAPK1 (0.42) | ALDH1A1CYP1A2CYP2C19PTGER4MAPT | |
| SCHEMBL29110044 | 0.72 | NPSR1 (0.45) | ALDH1A1CYP1A2CYP2C19PTGER4MAPT |
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 |