Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | GPR3 | P46089 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 5/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | AHR | P35869 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | TDO2 | P48775 | 2/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | HTR5A | P47898 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14564927 | 0.91 | AHR (0.42) | ALDH1A1HSD17B10GPR3HPGDSMN1; SMN2 | |
| SCHEMBL263074 | 0.89 | HPGD (0.40) | ALDH1A1HSD17B10GPR3HPGDSMN1; SMN2 | |
| SCHEMBL262363 | 0.88 | AHR (0.44) | ALDH1A1HSD17B10GPR3HPGDSMN1; SMN2 | |
| SCHEMBL30435195 | 0.87 | CDK4 (0.42) | HPGDSMN1; SMN2HTTMAPK1TDO2 | |
| SCHEMBL18351984 | 0.87 | AHR (0.41) | ALDH1A1HSD17B10GPR3HPGDSMN1; SMN2 | |
| SCHEMBL29511964 | 0.84 | ALDH1A1 (0.41) | ALDH1A1HSD17B10HPGDSMN1; SMN2MAPK1 | |
| SCHEMBL733459 | 0.84 | ALDH1A1 (0.41) | ALDH1A1HSD17B10HPGDSMN1; SMN2MAPK1 | |
| SCHEMBL263195 | 0.83 | CDK4 (0.41) | HPGDSMN1; SMN2HTTMAPK1GABRA1 | |
| SCHEMBL23660181 | 0.83 | CDK4 (0.41) | ALDH1A1HSD17B10HPGDSMN1; SMN2HTT | |
| SCHEMBL30021120 | 0.83 | MAOA (0.38) | HPGDSMN1; SMN2HTTMAPK1ESR1 |
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-109776471-A | A kind of coumarin type Developments of Third-order Nonlinear Optical Polymers and its preparation and application | 汕头大学 | 2019-05-21 | — | — | CN | disclosed |