Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 6/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.41 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.41 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.41 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.41 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | XBP1 | P17861 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL12972509 | 0.91 | GRIN2D (0.43) | TDP1TSHRGRIN2DGRIN3BGRIN1 | |
| SCHEMBL19511823 | 0.86 | TSHR (0.52) | TDP1TSHRALDH1A1CYP3A4ALOX15 | |
| SCHEMBL1708265 | 0.83 | TDP1 (0.45) | TDP1TSHRGRIN2DGRIN3BGRIN1 | |
| SCHEMBL29745076 | 0.83 | TDP1 (0.45) | TDP1TSHRGRIN2DGRIN3BGRIN1 | |
| SCHEMBL28202994 | 0.81 | GPR35 (0.48) | TDP1TSHRGRIN2DGRIN3BGRIN1 | |
| SCHEMBL1192809 | 0.79 | GRIN2D (0.39) | TDP1TSHRGRIN2DGRIN3BGRIN1 | |
| SCHEMBL10451240 | 0.78 | ALDH1A1 (0.55) | TDP1TSHRALDH1A1CYP3A4ALOX15 | |
| SCHEMBL31711437 | 0.75 | GRIN2D (0.42) | TDP1TSHRGRIN2DGRIN3BGRIN1 | |
| SCHEMBL31569072 | 0.75 | MAPT (0.45) | TDP1GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL20500421 | 0.75 | MAPT (0.45) | TDP1GRIN2DGRIN3BGRIN1GRIN2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109096123-B | Novel compound 6-fluoro-2, 4-diaminonitrobenzene and preparation method thereof | 郑州轻工业学院 | 2021-01-26 | — | — | CN | claimed |
| CN-109096123-B | Novel compound 6-fluoro-2, 4-diaminonitrobenzene and preparation method thereof | 郑州轻工业学院 | 2021-01-26 | — | — | CN | disclosed |
| CN-109096123-B | Novel compound 6-fluoro-2, 4-diaminonitrobenzene and preparation method thereof | 郑州轻工业学院 | 2021-01-26 | — | — | CN | disclosed |
| CN-109096123-B | Novel compound 6-fluoro-2, 4-diaminonitrobenzene and preparation method thereof | 郑州轻工业学院 | 2021-01-26 | — | — | CN | disclosed |