Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | EGFR | P00533 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | PDE5A | O76074 | 4/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28460390 | 0.88 | EGFR (0.55) | LMNAHTTSMN1; SMN2EGFRMAPT | |
| SCHEMBL28459657 | 0.88 | EGFR (0.47) | LMNAHTTSMN1; SMN2EGFRMAPT | |
| SCHEMBL28462518 | 0.83 | EGFR (0.46) | LMNAHTTSMN1; SMN2EGFRMAPT | |
| SCHEMBL28462514 | 0.82 | HTT (0.47) | LMNAHTTEGFRMAPTKMT2A | |
| SCHEMBL28469365 | 0.81 | SMN1; SMN2 (0.56) | LMNAHTTSMN1; SMN2EGFRMAPT | |
| SCHEMBL28471314 | 0.81 | MEN1 (0.54) | LMNAHTTSMN1; SMN2EGFRMAPT | |
| SCHEMBL28462520 | 0.79 | CTNNB1 (0.58) | LMNAHTTSMN1; SMN2EGFRKMT2A | |
| SCHEMBL28460393 | 0.79 | PTGFR (0.40) | HTTMAPTHDAC1 | |
| SCHEMBL28188044 | 0.79 | EGFR (0.48) | EGFRMAPTKMT2APDE5AMEN1 | |
| SCHEMBL28188742 | 0.79 | EGFR (0.73) | HTTEGFRMAPTHPGDALDH1A1 |
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-107522659-B | 3-nitroquinoline derivative and preparation method and application thereof | 云南大学 | 2020-09-29 | — | — | CN | disclosed |