Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | APEX1 | P27695 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | THPO | P40225 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | AURKA | O14965 | 5/20 | 0.48 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21463493 | 1.00 | LMNA (0.49) | LMNAKDM4ENPC1ALDH1A1TP53 | |
| SCHEMBL21463825 | 0.83 | MAPT (0.49) | LMNAKDM4ENPC1ALDH1A1TP53 | |
| SCHEMBL30615580 | 0.83 | MAPT (0.49) | LMNAKDM4ENPC1ALDH1A1TP53 | |
| SCHEMBL21467299 | 0.80 | MAPT (0.52) | LMNAKDM4ENPC1ALDH1A1TP53 | |
| SCHEMBL21463397 | 0.78 | LMNA (0.49) | LMNAKDM4ENPC1ALDH1A1TP53 | |
| SCHEMBL30615454 | 0.78 | AURKA (0.50) | LMNAKDM4ECYP1A2MAPTAURKA | |
| SCHEMBL21464410 | 0.78 | AURKA (0.50) | LMNAKDM4ECYP1A2MAPTAURKA | |
| SCHEMBL21463678 | 0.77 | HSP90AA1 (0.46) | LMNAKDM4ENPC1ALDH1A1TP53 | |
| SCHEMBL21463441 | 0.75 | AURKA (0.51) | LMNAKDM4ETP53MAPTAURKA | |
| SCHEMBL30615675 | 0.75 | AURKA (0.51) | LMNAKDM4ETP53MAPTAURKA |
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 |
|---|---|---|---|---|---|---|---|
| CN-111868037-B | Fused cyclic urea derivatives as CRHR2 antagonists | 拉夸里亚创药株式会社 | 2023-10-13 | — | — | CN | disclosed |