Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC2A1 | P11166 | 1/20 | 0.47 |
| ▸ | PDE2A | O00408 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | GRM8 | O00222 | 1/20 | 0.38 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.38 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | TACR1 | P25103 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.36 |
| ▸ | SLC7A5 | Q01650 | 3/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1729340 | 1.00 | SLC2A1 (0.47) | SLC2A1PDE2ASMN1; SMN2MEN1LMNA | |
| SCHEMBL1727664 | 1.00 | SLC2A1 (0.47) | SLC2A1PDE2ASMN1; SMN2MEN1LMNA | |
| SCHEMBL3602797 | 0.89 | PDE2A (0.43) | SLC2A1PDE2AGRM8GRM4TACR1 | |
| SCHEMBL3595268 | 0.89 | PDE2A (0.43) | SLC2A1PDE2AGRM8GRM4TACR1 | |
| SCHEMBL906156 | 0.89 | PDE2A (0.43) | SLC2A1PDE2AGRM8GRM4TACR1 | |
| SCHEMBL9350707 | 0.84 | SLC2A1 (0.59) | SLC2A1CA2CYP1A2CYP2C19 | |
| SCHEMBL9950997 | 0.84 | KIF11 (0.46) | PDE2A | |
| SCHEMBL27407732 | 0.84 | SLC2A1 (0.49) | SLC2A1LMNACA2TSHR | |
| SCHEMBL1727790 | 0.82 | TACR1 (0.43) | SLC2A1CA2EPHX1TACR1CYP3A4 | |
| SCHEMBL1727512 | 0.82 | TACR1 (0.43) | SLC2A1CA2EPHX1TACR1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3177611-B1 | OPTIONALLY FUSED HETEROCYCLYL-SUBSTITUTED DERIVATIVES OF PYRIMIDINE USEFUL FOR THE TREATMENT OF INFLAMMATORY, METABOLIC, ONCOLOGIC AND AUTOIMMUNE DISEASES | NUEVOLUTION AS (DK) | 2021-10-06 | — | — | EP | disclosed |