Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | LMNA | P02545 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | GMNN | O75496 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL26173644 | 0.87 | TSHR (0.41) | TSHRALDH1A1LMNAKDM4EPKM | |
| SCHEMBL26173638 | 0.77 | HCAR3 (0.33) | TSHRALDH1A1LMNAKDM4EPKM | |
| SCHEMBL26124340 | 0.77 | HCAR3 (0.33) | TSHRALDH1A1LMNAKDM4EPKM | |
| SCHEMBL31384132 | 0.77 | HCAR3 (0.33) | TSHRALDH1A1LMNAKDM4EPKM | |
| SCHEMBL10073316 | 0.75 | PDE4D (0.55) | ALDH1A1LMNAKDM4EPKMNPSR1 | |
| SCHEMBL26173716 | 0.73 | TSHR (0.38) | TSHRALDH1A1LMNAKDM4EPKM | |
| SCHEMBL26173650 | 0.71 | HTR2C (0.40) | TSHRALDH1A1LMNAKDM4EPKM | |
| SCHEMBL14725180 | 0.70 | ALDH1A1 (0.58) | TSHRALDH1A1LMNAKDM4ENPSR1 | |
| SCHEMBL6504933 | 0.68 | KDM4E (0.65) | ALDH1A1LMNAKDM4EPKMNPSR1 | |
| SCHEMBL12575834 | 0.68 | LMNA (0.51) | TSHRALDH1A1LMNAKDM4EPKM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023104165-A1 | PYRIDINE[4,3-D]PYRIMIDINE COMPOUND AS TLR7/8 AGONIST | 上海维申医药有限公司 | 2023-06-15 | — | — | WO | disclosed |