Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.43 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.43 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.43 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.43 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.43 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.43 |
| ▸ | CTSV | O60911 | 2/20 | 0.42 |
| ▸ | CTSL | P07711 | 2/20 | 0.42 |
| ▸ | GABRP | O00591 | 1/20 | 0.41 |
| ▸ | GABRD | O14764 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.41 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.41 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.41 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28387283 | 0.78 | NR4A2 (0.65) | ALDH1A1KDM4EATMMEN1HPGD | |
| SCHEMBL5950144 | 0.77 | AHR (0.52) | ALDH1A1KDM4ESMN1; SMN2MAPTATM | |
| SCHEMBL30202503 | 0.75 | GRIN2D (0.56) | ALDH1A1KDM4ESMN1; SMN2ATMGRIN2D | |
| SCHEMBL25331940 | 0.74 | GRIN2D (0.46) | ALDH1A1KDM4ESMN1; SMN2ATMGRIN2D | |
| SCHEMBL8873579 | 0.74 | GRIN2D (0.63) | ALDH1A1KDM4EMAPTGRIN2DGRIN3B | |
| SCHEMBL1472915 | 0.74 | GRIN2D (0.46) | ALDH1A1KDM4ESMN1; SMN2ATMGRIN2D | |
| SCHEMBL17950573 | 0.72 | MAPT (0.48) | ALDH1A1KDM4EMAPTATMGRIN2D | |
| SCHEMBL4065612 | 0.72 | KDM4E (0.72) | ALDH1A1KDM4ESMN1; SMN2MAPTATM | |
| SCHEMBL28391349 | 0.71 | ESR1 (0.55) | ALDH1A1KDM4EMAPTGRIN2DGRIN3B | |
| SCHEMBL28389481 | 0.71 | GRIN2D (0.44) | ALDH1A1KDM4ESMN1; SMN2MAPTATM |
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-108689907-B | Method for preparing 2-nitroindole derivative | 苏州大学 | 2020-05-01 | — | — | CN | disclosed |
| CN-108689907-A | A method of preparing 2- nitroindole derivatives | 苏州大学 | 2018-10-23 | — | — | CN | disclosed |
| WO-2012024558-A2 | LIGHT MEDIATED REGULATION OF PROTEIN DIMERIZATION | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 2012-02-23 | — | — | WO | disclosed |