Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 2/20 | 0.45 |
| ▸ | DRD3 | P35462 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | KAT2B | Q92831 | 2/20 | 0.42 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL18740427 | 0.88 | RAD51 (0.41) | KCNH2CYP2D6RAD51SLC6A2SLC6A4 | |
| SCHEMBL8554615 | 0.82 | SLC6A2 (0.47) | DRD2DRD3ALDH1A1HSP90AA1KCNH2 | |
| SCHEMBL22481515 | 0.81 | HDAC6 (0.46) | ROCK2HDAC6LMNA | |
| SCHEMBL18740192 | 0.80 | ROCK2 (0.38) | KMT2AMEN1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL16874727 | 0.79 | CCR1 (0.39) | ALDH1A1CYP1A2CYP2C19MAPTROCK2 | |
| SCHEMBL16885989 | 0.79 | CCR1 (0.39) | ALDH1A1CYP1A2CYP2C19MAPTROCK2 | |
| SCHEMBL6530315 | 0.79 | CYP2D6 (0.50) | DRD2DRD3KCNH2CYP1A2CYP2D6 | |
| SCHEMBL2289335 | 0.79 | ALDH1A1 (0.46) | DRD2DRD3ALDH1A1HSP90AA1KCNH2 | |
| SCHEMBL27509176 | 0.79 | DRD2 (0.40) | DRD2DRD3ALDH1A1HSP90AA1KCNH2 | |
| SCHEMBL5827625 | 0.77 | MCHR1 (0.47) | ALDH1A1SLC6A2SLC6A4SLC6A3HTT |
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-1203599-A | Substitued pyrrolidinone, thiazolidinone or oxazolidinone as herbicides | ZENECA LTD (GB) | 1998-12-30 | — | — | CN | disclosed |
| EP-0863894-A1 | SUBSTITUTED PYRROLIDINONE, THIAZOLIDINONE OR OXAZOLIDINONE AS HERBICIDES | ZENECA LIMITED (GB) | 1998-09-16 | — | — | EP | disclosed |
| US-5705456-A | AZETIDIN-2-ONES | ZENECA LIMITED (GB) | 1998-01-06 | — | — | US | disclosed |
| WO-1997020838-A1 | SUBSTITUTED PYRROLIDINONE, THIAZOLIDINONE OR OXAZOLIDINONE AS HERBICIDES | ZENECA LIMITED (GB) | 1997-06-12 | — | — | WO | disclosed |