Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 3/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 2/20 | 0.33 |
| ▸ | ACACB | O00763 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | AR | P10275 | 3/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL29093972 | 0.87 | ATM (0.38) | ATMCNR2CTSKACACBNPC1 | |
| SCHEMBL29093973 | 0.87 | ATM (0.38) | ATMCNR2CTSKACACBNPC1 | |
| SCHEMBL30557769 | 0.85 | ATM (0.36) | ATMCTSKACACBNPC1RAB9A | |
| SCHEMBL29093747 | 0.85 | ATM (0.36) | ATMCTSKACACBNPC1RAB9A | |
| SCHEMBL29093472 | 0.78 | ATM (0.41) | ATMCNR2CTSKACACBNPC1 | |
| SCHEMBL29093473 | 0.78 | ATM (0.41) | ATMCNR2CTSKACACBNPC1 | |
| SCHEMBL20283847 | 0.74 | LATS1 (0.40) | ACACBHDAC3HDAC1HDAC2HDAC10 | |
| SCHEMBL26750156 | 0.73 | ADORA2A (0.40) | ATMCNR2ACACBALDH1A1AR | |
| SCHEMBL17594367 | 0.71 | ATM (0.60) | ATMNPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL20283970 | 0.70 | PDCD1LG2 (0.37) | ATMACACBNPC1RAB9ASMN1; SMN2 |
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-116768883-A | Pyrimido aromatic ring compounds and application thereof in medicines | 广东东阳光药业股份有限公司 | 2023-09-19 | — | — | CN | disclosed |