Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.55 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.52 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.52 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.52 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.51 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.51 |
| ▸ | KIF11 | P52732 | 1/20 | 0.49 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | HSPB1 | P04792 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL31138869 | 0.85 | ALDH1A1 (0.53) | ALDH1A1HIF1ATDP1GPR35MAPK1 | |
| SCHEMBL4310481 | 0.85 | ALDH1A1 (0.53) | ALDH1A1HIF1ATDP1GPR35MAPK1 | |
| SCHEMBL1999857 | 0.84 | PDE7A (0.54) | ALDH1A1HIF1ATDP1MAPK1TSHR | |
| SCHEMBL11653204 | 0.82 | ALDH1A1 (0.51) | ALDH1A1HIF1ATDP1GPR35MAPK1 | |
| SCHEMBL4747577 | 0.81 | TDP1 (0.55) | ALDH1A1HIF1ATDP1GPR35MAPK1 | |
| SCHEMBL446475 | 0.81 | TDP1 (0.55) | ALDH1A1HIF1ATDP1GPR35MAPK1 | |
| SCHEMBL1995690 | 0.81 | ALDH1A1 (0.56) | ALDH1A1HIF1ATDP1MAPK1HPGD | |
| SCHEMBL8192824 | 0.81 | KIF11 (0.49) | ALDH1A1HIF1ATDP1MAPK1TP53 | |
| SCHEMBL30619304 | 0.81 | ALDH1A1 (0.53) | ALDH1A1HIF1ATDP1TSHRKIF11 | |
| SCHEMBL29398386 | 0.81 | ALDH1A1 (0.56) | ALDH1A1HIF1ATDP1MAPK1HPGD |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110713454-A | Nitro-substituted indole compound and preparation method thereof | 南京工业大学 | 2020-01-21 | — | — | CN | claimed |
| CN-110713454-A | Nitro-substituted indole compound and preparation method thereof | 南京工业大学 | 2020-01-21 | — | — | CN | disclosed |
| CN-102557965-A | Preparation method for 2,4-diamido-benzotrifluoride | SHANGHAI SINOFLUORO SCIENT CO | 2012-07-11 | — | — | CN | disclosed |
| CN-102557965-A | Preparation method for 2,4-diamido-benzotrifluoride | SHANGHAI SINOFLUORO SCIENT CO | 2012-07-11 | — | — | CN | disclosed |
| US-6103860-A | LOW DIELECTRIC CONSTANT, EXCELLENT TRANSPARENCY, LOW HYGROSCOPICITY AND EXCELLENT PROCESSABILITY; SUBSTRATE FOR AN OPTICAL DISK, A PICK-UP LENS, A PLASTIC SUBSTRATE FOR A LIQUID CELL AND A PRISM | MITSUI CHEMICALS, INC. (JP) | 2000-08-15 | — | — | US | disclosed |
| US-5990261-A | Organic optical component | MITSUI CHEMICALS, INC. (JP) | 1999-11-23 | — | — | US | disclosed |
| CN-1184123-A | Organic optical component | MITSUI TOATSU CHEMICALS (JP) | 1998-06-10 | — | — | CN | disclosed |
| EP-0826717-A1 | An organic optical component | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1998-03-04 | — | — | EP | disclosed |