Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.47 |
| ▸ | DRD4 | P21917 | 3/20 | 0.42 |
| ▸ | DRD2 | P14416 | 2/20 | 0.42 |
| ▸ | DRD3 | P35462 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | MC4R | P32245 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | FUCA1 | P04066 | 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 | |
|---|---|---|---|---|
| SCHEMBL5777524 | 0.83 | SIGMAR1 (0.48) | SIGMAR1DRD4DRD2DRD3MC4R | |
| SCHEMBL8663190 | 0.83 | SIGMAR1 (0.47) | SIGMAR1DRD4ALDH1A1LMNAMC4R | |
| SCHEMBL27785701 | 0.73 | SIGMAR1 (0.41) | SIGMAR1ALDH1A1LMNANPSR1MC4R | |
| SCHEMBL6621542 | 0.73 | SIGMAR1 (0.52) | SIGMAR1DRD4ALDH1A1LMNAMC4R | |
| SCHEMBL28039452 | 0.72 | SIGMAR1 (0.47) | SIGMAR1ALDH1A1LMNAFUCA1 | |
| SCHEMBL325929 | 0.70 | SIGMAR1 (0.48) | SIGMAR1DRD4LMNAMC4RPOLB | |
| SCHEMBL10296078 | 0.70 | SIGMAR1 (0.48) | SIGMAR1DRD4LMNAMC4RGAA | |
| Hydrochloric Acid SCHEMBL10354317 | 0.70 | DRD2 (0.49) | SIGMAR1DRD4DRD2DRD3LMNA | |
| SCHEMBL19087069 | 0.70 | SIGMAR1 (0.48) | SIGMAR1DRD4ALDH1A1LMNAMC4R | |
| SCHEMBL1344511 | 0.70 | CYP2D6 (0.46) | SIGMAR1ALDH1A1LMNAMC4RACHE |
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 |
|---|---|---|---|---|---|---|---|
| US-5783708-A | HEXAHYDROISOINDOLE DERIVATIVES | BAYER AKTIENGESELLSCHAFT (DE) | 1998-07-21 | — | — | US | disclosed |
| US-5703094-A | Quinolone- and naphthyridonecarboxylic acid derivatives | BAYER AKTIENGESELLSCHAFT (DE) | 1997-12-30 | — | — | US | disclosed |
| EP-0721948-B1 | Quinolone- and naphthyridone carboxylic acid derivatives as antibacterial agents | BAYER AG (DE) | 1997-12-03 | — | — | EP | disclosed |
| EP-0721948-A1 | Quinolone- and naphthyridone carboxylic acid derivatives as antibacterial agents | BAYER AG (DE) | 1996-07-17 | — | — | EP | disclosed |