Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.40 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.40 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.40 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.36 |
| ▸ | PMM2 | O15305 | 1/20 | 0.36 |
| ▸ | MPI | P34949 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10896862 | 0.87 | CYP3A4 (0.52) | CYP3A4ALDH1A1TSHRTDP1HSP90AA1 | |
| SCHEMBL4575697 | 0.81 | CYP3A4 (0.46) | CYP3A4ALDH1A1TSHRTDP1PMM2 | |
| SCHEMBL28049512 | 0.81 | TSHR (0.50) | CYP3A4ALDH1A1TSHRTDP1MEN1 | |
| SCHEMBL14379109 | 0.79 | ALDH1A1 (0.60) | CYP3A4ALDH1A1TSHRTDP1MEN1 | |
| SCHEMBL11114667 | 0.79 | GRIN2D (0.42) | GRIN2DGRIN3BGRIN1GRIN2AGRIN2B | |
| SCHEMBL28069553 | 0.78 | PLAU (0.56) | GRIN2DGRIN3BGRIN1GRIN2AGRIN2B | |
| SCHEMBL670917 | 0.77 | TSHR (0.58) | CYP3A4GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL6172008 | 0.77 | ALDH1A1 (0.41) | GRIN2DGRIN3BGRIN1GRIN2AGRIN2B | |
| SCHEMBL10974014 | 0.76 | PLAU (0.45) | CYP3A4ALDH1A1TSHRTDP1KDM4E | |
| SCHEMBL29011317 | 0.74 | CYP3A4 (0.37) | CYP3A4ALDH1A1TDP1PMM2MPI |
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-110068616-A | The normal-phase chromatography analysis method of chloro- 2 nitrophenyl isocyanate of 4- and its reaction solution | 联化科技股份有限公司 | 2019-07-30 | — | — | CN | claimed |
| CN-110068616-A | The normal-phase chromatography analysis method of chloro- 2 nitrophenyl isocyanate of 4- and its reaction solution | 联化科技股份有限公司 | 2019-07-30 | — | — | CN | disclosed |
| CN-110068616-A | The normal-phase chromatography analysis method of chloro- 2 nitrophenyl isocyanate of 4- and its reaction solution | 联化科技股份有限公司 | 2019-07-30 | — | — | CN | disclosed |
| CN-110068616-A | The normal-phase chromatography analysis method of chloro- 2 nitrophenyl isocyanate of 4- and its reaction solution | 联化科技股份有限公司 | 2019-07-30 | — | — | CN | disclosed |