Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GCGR | P47871 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CTSV | O60911 | 1/20 | 0.30 |
| ▸ | CTSL | P07711 | 1/20 | 0.30 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29952269 | 0.84 | ADORA2A (0.33) | GCGRMAPK14 | |
| SCHEMBL29956407 | 0.84 | KDM4E (0.37) | MAPK14LMNAALDH1A1 | |
| SCHEMBL15332489 | 0.82 | HSD17B10 (0.33) | GCGRMAPK14 | |
| SCHEMBL15330797 | 0.82 | TYR (0.39) | GCGRMAPK14ALDH1A1HPGDNOTUM | |
| SCHEMBL15332657 | 0.81 | CNR1 (0.39) | GCGRMAPK14MEN1KMT2ACTSV | |
| SCHEMBL2562664 | 0.81 | MPL (0.33) | GCGRMAPK14SMN1; SMN2CYP2C19NPC1 | |
| SCHEMBL29951548 | 0.81 | MPL (0.33) | GCGRMAPK14SMN1; SMN2CYP2C19NPC1 | |
| SCHEMBL15331684 | 0.80 | PTGS2 (0.34) | NOTUM | |
| SCHEMBL29957064 | 0.79 | KDM4E (0.34) | SMN1; SMN2CYP2C19NPC1CYP1A2RAB9A | |
| SCHEMBL15332033 | 0.78 | ERN1 (0.36) | — |
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 |