Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 2/20 | 0.53 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.53 |
| ▸ | BACE1 | P56817 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | AURKA | O14965 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8666417 | 1.00 | KDR (0.53) | KDRCHEK1BACE1RAB9ANPC1 | |
| SCHEMBL8992187 | 0.88 | KDR (0.53) | KDRCHEK1RAB9ANPC1MAPT | |
| SCHEMBL22541432 | 0.85 | CYP19A1 (0.48) | KDRCHEK1RAB9ANPC1MAPT | |
| SCHEMBL22541398 | 0.85 | CYP19A1 (0.48) | KDRCHEK1RAB9ANPC1MAPT | |
| SCHEMBL6626948 | 0.84 | KDR (0.53) | KDRCHEK1RAB9ANPC1MAPT | |
| SCHEMBL8717848 | 0.81 | KDR (0.49) | KDRCHEK1RAB9ANPC1MAPT | |
| SCHEMBL30968195 | 0.78 | KDR (0.61) | KDRCHEK1RAB9ANPC1MAPT | |
| SCHEMBL7605733 | 0.78 | BACE1 (0.60) | BACE1RAB9ANPC1MAPTMEN1 | |
| SCHEMBL1158440 | 0.74 | KDR (0.51) | KDRCHEK1RAB9ANPC1MAPT | |
| SCHEMBL31055001 | 0.74 | KDR (0.51) | KDRCHEK1RAB9ANPC1MAPT |
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-115594627-A | 5-hydronaphtho [2,3-c ] carbazole dione derivative, preparation method and application | 西华大学（CN） | 2023-01-13 | — | — | CN | disclosed |