Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP2A | P11388 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.46 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.43 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.43 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.43 |
| ▸ | CDK1 | P06493 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2237236 | 0.91 | GLO1 (0.47) | TOP2AKDM4EALDH1A1GAAGFER | |
| SCHEMBL3358739 | 0.86 | TOP2A (0.59) | TOP2AKDM4EALDH1A1GAAGFER | |
| SCHEMBL6666438 | 0.79 | KDM4E (0.52) | KDM4EALDH1A1CYP2E1CYP3A4CYP2A6 | |
| SCHEMBL27863584 | 0.79 | CDK5 (0.45) | TOP2AKDM4EALDH1A1GAACYP2E1 | |
| SCHEMBL2495047 | 0.79 | CDK5 (0.45) | TOP2AKDM4EALDH1A1GAAGFER | |
| SCHEMBL12949721 | 0.79 | GLO1 (0.42) | TOP2AKDM4EALDH1A1GAAGFER | |
| SCHEMBL28132260 | 0.77 | KDM4E (0.50) | KDM4EALDH1A1GAACYP2E1CYP3A4 | |
| Hydrochloric Acid SCHEMBL6667707 | 0.77 | KDM4E (0.50) | KDM4EALDH1A1GAACYP2E1CYP3A4 | |
| SCHEMBL28335119 | 0.77 | KDM4E (0.50) | KDM4EALDH1A1GAACYP2E1CYP3A4 | |
| SCHEMBL2495572 | 0.76 | KDM4E (0.50) | TOP2AKDM4EALDH1A1GAAGFER |
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-106083845-A | A kind of 1,5 naphthyridine type luminous organic material compounds and synthetic method thereof and application | 金陵科技学院 | 2016-11-09 | — | — | CN | disclosed |