Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | ASPH | Q12797 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | BLVRB | P30043 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.38 |
| ▸ | RXRA | P19793 | 1/20 | 0.38 |
| ▸ | RXRB | P28702 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.38 |
| ▸ | HTR3B | O95264 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28850888 | 0.86 | CES2 (0.43) | CES2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL21121922 | 0.80 | CES2 (0.41) | CES2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL7202105 | 0.78 | MEN1 (0.50) | KDM4EALDH1A1HSD17B10MEN1PDE4A | |
| SCHEMBL25838145 | 0.77 | ALB (0.42) | CES2KDM4EALDH1A1ASPHMEN1 | |
| SCHEMBL940864 | 0.76 | RXRB (0.54) | CES2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL31000476 | 0.76 | RXRB (0.54) | CES2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL9640565 | 0.76 | TSHR (0.48) | CES2ALDH1A1HPGDHSD17B10MEN1 | |
| SCHEMBL28176917 | 0.76 | RXRA (0.44) | RXRARXRBCYP1A2 | |
| SCHEMBL11405370 | 0.76 | MRGPRX4 (0.39) | CES2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL3036944 | 0.75 | ASPH (0.59) | CES2KDM4EALDH1A1HPGDHSD17B10 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107995912-A | MAYTANSINOID DERIVATIVES, CONJUGATES THEREOF, AND METHODS OF USE | 里珍纳龙药品有限公司 | 2018-05-04 | — | — | CN | disclosed |
| CN-107922319-A | Urea derivative and its purposes | 东丽株式会社 | 2018-04-17 | — | — | CN | disclosed |
| CN-107922320-A | Urea derivative and its purposes | 东丽株式会社 | 2018-04-17 | — | — | CN | disclosed |