Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 2/20 | 0.60 |
| ▸ | TDO2 | P48775 | 12/20 | 0.54 |
| ▸ | HTR2B | P41595 | 3/20 | 0.54 |
| ▸ | HTR5A | P47898 | 3/20 | 0.54 |
| ▸ | HTR2C | P28335 | 1/20 | 0.52 |
| ▸ | IDO1 | P14902 | 5/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | GABRP | O00591 | 1/20 | 0.49 |
| ▸ | GABRD | O14764 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.49 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL3133995 | 0.89 | TDO2 (0.66) | BCHETDO2HTR2BHTR5AHTR2C | |
| SCHEMBL16763182 | 0.89 | TDO2 (0.61) | BCHETDO2HTR2BHTR5AHTR2C | |
| Biphenyl SCHEMBL29268745 | 0.87 | TDO2 (0.56) | BCHETDO2HTR2BHTR5AHTR2C | |
| SCHEMBL20600867 | 0.86 | BCHE (0.56) | BCHETDO2HTR2BHTR5AHTR2C | |
| SCHEMBL30021743 | 0.84 | BCHE (0.48) | BCHETDO2HTR2BHTR5AHTR2C | |
| SCHEMBL16516087 | 0.83 | KIF11 (0.61) | BCHETDO2HTR2BHTR5AHTR2C | |
| SCHEMBL20600847 | 0.83 | BCHE (0.51) | BCHETDO2HTR2BHTR5AHTR2C | |
| SCHEMBL29733506 | 0.82 | KIF11 (0.63) | BCHEGABRPGABRDALDH1A1GABRA1 | |
| SCHEMBL208113 | 0.82 | KIF11 (0.63) | BCHEGABRPGABRDALDH1A1GABRA1 | |
| SCHEMBL29986280 | 0.82 | TDO2 (0.50) | BCHETDO2HTR2BHTR5AHTR2C |
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-104151296-A | Synthesis method and application of pyridine derivatives | NANJING UNIVERSITY OF TECHNOLOGY | 2014-11-19 | — | — | CN | disclosed |