Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | FBP1 | P09467 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.52 |
| ▸ | DRD2 | P14416 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.52 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.52 |
| ▸ | DRD1 | P21728 | 1/20 | 0.52 |
| ▸ | MC5R | P33032 | 1/20 | 0.52 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.52 |
| ▸ | DRD3 | P35462 | 1/20 | 0.52 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.52 |
| ▸ | CCR2 | P41597 | 1/20 | 0.52 |
| ▸ | HTR6 | P50406 | 1/20 | 0.52 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.52 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL76778 | 0.98 | ALDH1A1 (0.54) | ALDH1A1FBP1TDP1HSD17B10ADRA2A | |
| Hydrochloric Acid SCHEMBL2283945 | 0.95 | ALDH1A1 (0.52) | ALDH1A1FBP1TDP1HSD17B10ADRA2A | |
| Chlorobenzene SCHEMBL28283079 | 0.90 | FBP1 (0.56) | ALDH1A1FBP1TDP1HSD17B10ADRA2A | |
| SCHEMBL27462536 | 0.90 | FBP1 (0.47) | ALDH1A1FBP1TDP1HSD17B10ADRA2A | |
| SCHEMBL27609987 | 0.90 | FBP1 (0.47) | ALDH1A1FBP1TDP1HSD17B10ADRA2A | |
| SCHEMBL28283078 | 0.88 | RAB9A (0.51) | ALDH1A1FBP1TDP1HSD17B10ADRA2A | |
| SCHEMBL6247403 | 0.86 | CASR (0.45) | ALDH1A1FBP1TDP1HSD17B10ADRA2A | |
| SCHEMBL30066934 | 0.81 | FBP1 (0.40) | ALDH1A1FBP1TDP1HSD17B10ADRA2A | |
| Oxazole SCHEMBL28355211 | 0.80 | NPC1 (0.42) | ALDH1A1FBP1TDP1HSD17B10ADRA2A | |
| SCHEMBL8971386 | 0.78 | SMN1; SMN2 (0.49) | ALDH1A1FBP1TDP1HSD17B10HPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4740596-A | Process for preparation of 4-sulfonylthio azetidinone derivatives | OTSUKA KAGAKU KABUSHIKI KAISHA (JP) | 1988-04-26 | — | — | US | disclosed |
| US-4713452-A | Process for preparation of azetidinone derivatives | OTSUKA KAGAKU KABUSHIKI KAISHA (JP) | 1987-12-15 | — | — | US | disclosed |