Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TOP2A | P11388 | 1/20 | 0.39 |
| ▸ | RPA1 | P27694 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3903902 | 0.82 | PDE4D (0.46) | LMNAMAPK1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL8564481 | 0.78 | CYP1A2 (0.55) | TSHRPOLBKDM4EALDH1A1HPGD | |
| SCHEMBL3881842 | 0.75 | MLNR (0.62) | MEN1KMT2ALMNAPOLBMAPK1 | |
| SCHEMBL13637331 | 0.67 | ALDH1A1 (0.57) | MEN1KMT2ALMNATSHRPOLB | |
| SCHEMBL7092640 | 0.67 | POLB (0.64) | MEN1KMT2ALMNATSHRPOLB | |
| SCHEMBL284619 | 0.66 | SLC9A1 (0.49) | POLBMAPK1ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL3796565 | 0.66 | APAF1 (0.45) | MEN1KMT2ALMNATSHRPOLB | |
| SCHEMBL13031107 | 0.65 | TSHR (0.57) | MEN1KMT2ALMNATSHRPOLB | |
| SCHEMBL8311054 | 0.64 | ATM (0.54) | MEN1KMT2ATSHRPOLBMAPK1 | |
| SCHEMBL6930941 | 0.64 | CYP1A2 (0.51) | MEN1KMT2ALMNATSHRPOLB |
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 |
|---|---|---|---|---|---|---|---|
| US-5563140-A | Use of 1-(aminoalkyl)-3-(benzyl)-quinoxaline-2-one derivatives for the preparation of neuroprotective compositions | PHAFAG AKTIENGESELLSCHAFT (LI) | 1996-10-08 | — | — | US | disclosed |