Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | DAO | P14920 | 1/20 | 0.34 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | HPGD | P15428 | 3/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.30 |
| ▸ | PRKCB | P05771 | 1/20 | 0.30 |
| ▸ | CDK1 | P06493 | 1/20 | 0.30 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.30 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.30 |
| ▸ | CDK2 | P24941 | 1/20 | 0.30 |
| ▸ | GSK3B | P49841 | 1/20 | 0.30 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22996403 | 0.81 | BRD4 (0.33) | SMN1; SMN2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL23702701 | 0.74 | KDM4E (0.35) | DAOKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL14013817 | 0.65 | POLB (0.36) | KDM4EALDH1A1HPGDHSD17B10CYP1A2 | |
| SCHEMBL8193219 | 0.64 | KDM4E (0.32) | KDM4EALDH1A1GAA | |
| SCHEMBL8186780 | 0.61 | DHODH (0.33) | KDM4EALDH1A1HPGDPKMGAA | |
| SCHEMBL12190827 | 0.60 | KDM4E (0.38) | SMN1; SMN2KDM4EALDH1A1HPGDCYP1A2 | |
| SCHEMBL4160547 | 0.59 | GSK3B (0.34) | SMN1; SMN2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL10584632 | 0.58 | HCAR2 (0.40) | DAOHCAR2KDM4EALDH1A1POLB | |
| SCHEMBL12953817 | 0.57 | KDM4E (0.45) | SMN1; SMN2HCAR2KDM4EALDH1A1HPGD | |
| SCHEMBL16234206 | 0.57 | DAO (0.43) | SMN1; SMN2DAOHCAR2KDM4EPKM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021027503-A1 | TRICYCLIC COMPOUND, PREPARATION METHOD THEREFOR, AND INTERMEDIATE AND USE THEREOF | 罗欣药业(上海)有限公司 | 2021-02-18 | — | — | WO | disclosed |