Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | SPR | P35270 | 2/20 | 0.33 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | PDE5A | O76074 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | MIF | P14174 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | PDE4A | P27815 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5080208 | 0.74 | MAP4K4 (0.47) | MAP4K4EGFRALDH1A1ADORA2AADORA1 | |
| SCHEMBL807452 | 0.73 | MAP4K4 (0.50) | MAP4K4EGFRPIK3CDPIK3R1PIK3CA | |
| SCHEMBL807453 | 0.70 | MAP4K4 (0.47) | MAP4K4EGFRADORA2AADORA1PIK3CD | |
| SCHEMBL30989127 | 0.70 | MAP4K4 (0.47) | MAP4K4EGFRADORA2APIK3CDPIK3R1 | |
| SCHEMBL12314541 | 0.70 | MAP4K4 (0.47) | MAP4K4LMNAEGFRPDE5AALDH1A1 | |
| SCHEMBL29350296 | 0.70 | MAP4K4 (0.47) | MAP4K4EGFRPIK3CDPIK3R1PIK3CA | |
| SCHEMBL25273564 | 0.68 | MAP4K4 (0.41) | MAP4K4EGFRMEN1PDE5AALDH1A1 | |
| SCHEMBL30280494 | 0.68 | MAP4K4 (0.41) | MAP4K4LMNAEGFRCYP1A2CYP2D6 | |
| SCHEMBL25270993 | 0.68 | BAZ1A (0.41) | LMNAMEN1ALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL16635772 | 0.67 | MAP4K4 (0.40) | MAP4K4EGFRPIK3CDPIK3R1PIK3CA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114621233-A | Substituted aromatic condensed ring derivative and its composition and use | 深圳市塔吉瑞生物医药有限公司 | 2022-06-14 | — | — | CN | disclosed |
| CN-112552302-B | Substituted aromatic fused ring derivatives, compositions and uses thereof | 深圳市塔吉瑞生物医药有限公司 | 2022-05-13 | — | — | CN | disclosed |