Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 1/20 | 0.46 |
| ▸ | CCND1 | P24385 | 1/20 | 0.46 |
| ▸ | GSK3B | P49841 | 1/20 | 0.46 |
| ▸ | LCK | P06239 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | PARP1 | P09874 | 2/20 | 0.42 |
| ▸ | KIF11 | P52732 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27775653 | 0.89 | CDK4 (0.46) | CDK4CCND1GSK3BLCKNPC1 | |
| SCHEMBL27814900 | 0.88 | NPC1 (0.55) | CDK4CCND1GSK3BLCKNPC1 | |
| SCHEMBL27754988 | 0.87 | CDK4 (0.63) | CDK4CCND1GSK3BLCKNPC1 | |
| SCHEMBL27754996 | 0.86 | CDK4 (0.53) | CDK4CCND1GSK3BLCKNPC1 | |
| SCHEMBL27755225 | 0.82 | LCK (0.44) | CDK4CCND1GSK3BLCKKMT2A | |
| SCHEMBL27775814 | 0.80 | TLR8 (0.42) | CDK4CCND1GSK3BLCKNPC1 | |
| SCHEMBL27754977 | 0.78 | ALDH1A1 (0.46) | CDK4CCND1GSK3BNPC1KMT2A | |
| SCHEMBL27776073 | 0.77 | CDK4 (0.63) | CDK4CCND1GSK3BLCKNPC1 | |
| SCHEMBL27775823 | 0.75 | KDM4E (0.51) | CDK4CCND1GSK3BLCKNPC1 | |
| SCHEMBL27755295 | 0.75 | GSK3B (0.78) | CDK4CCND1GSK3BNPC1KMT2A |
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-101519372-B | Benzo [e] isoindazole-1,3 diketone compound used as GSK inhibiting agent and preparation method thereof | SHENZHEN SHENGJIE BIOLOGY TECHNOLOGY CO LTD | 2011-07-20 | — | — | CN | disclosed |
| CN-101519372-A | Benzo [e] isoindazole-1,3 diketone compound used as GSK inhibiting agent and preparation method thereof | SHENZHEN SHENGJIE BIOLOGY TECH | 2009-09-02 | — | — | CN | disclosed |