Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.48 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 3/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.34 |
| ▸ | FEN1 | P39748 | 1/20 | 0.32 |
| ▸ | PRKCI | P41743 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | XBP1 | P17861 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3285467 | 0.81 | GABRA1 (0.64) | GABRA1GABRB2ALDH1A1LMNA | |
| SCHEMBL45861 | 0.81 | GABRA1 (0.68) | GABRA1GABRB2ESR1ESR2FEN1 | |
| SCHEMBL3087121 | 0.81 | ALDH1A1 (0.39) | ALDH1A1KDM4ENPC1MAPTXBP1 | |
| SCHEMBL4652293 | 0.72 | MEN1 (0.40) | GABRA1GABRB2ALDH1A1LMNAESR1 | |
| SCHEMBL3078639 | 0.72 | MAPT (0.42) | ALDH1A1KDM4ENPC1MAPTXBP1 | |
| SCHEMBL2475390 | 0.72 | GABRA1 (0.56) | GABRA1GABRB2ESR1ESR2PRKCI | |
| SCHEMBL29719025 | 0.72 | GABRA1 (0.56) | GABRA1GABRB2ESR1ESR2PRKCI | |
| SCHEMBL20861837 | 0.71 | HSP90AA1 (0.39) | ALDH1A1LMNAKDM4ENPC1MAPT | |
| SCHEMBL5196215 | 0.70 | PRKCI (0.57) | GABRA1GABRB2ESR1ESR2PRKCI | |
| SCHEMBL5676415 | 0.70 | GABRA1 (0.54) | GABRA1GABRB2ALDH1A1ESR1ESR2 |
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-108191683-A | Method for preparing N, N-dihydroxyethyl-4-nitrosoaniline in pipeline manner | 浙江鼎龙科技有限公司 | 2018-06-22 | — | — | CN | claimed |