Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 6/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.64 |
| ▸ | HPGD | P15428 | 4/20 | 0.64 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.64 |
| ▸ | GRM1 | Q13255 | 3/20 | 0.64 |
| ▸ | MEN1 | O00255 | 3/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.64 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.64 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | GRM8 | O00222 | 1/20 | 0.53 |
| ▸ | GRM6 | O15303 | 1/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.53 |
| ▸ | DRD3 | P35462 | 1/20 | 0.53 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | BLM | P54132 | 3/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11451469 | 0.85 | HSD17B10 (0.46) | HSD17B10KDM4ETDP1ALDH1A1HPGD | |
| SCHEMBL11386312 | 0.85 | HSD17B10 (0.46) | HSD17B10KDM4ETDP1ALDH1A1HPGD | |
| SCHEMBL31091372 | 0.85 | HSD17B10 (0.56) | HSD17B10KDM4ETDP1ALDH1A1HPGD | |
| SCHEMBL11386310 | 0.84 | HSD17B10 (0.45) | HSD17B10KDM4ETDP1ALDH1A1HPGD | |
| SCHEMBL3478437 | 0.82 | TDP1 (0.70) | HSD17B10KDM4ETDP1ALDH1A1HPGD | |
| SCHEMBL10723439 | 0.82 | TDP1 (0.70) | HSD17B10KDM4ETDP1ALDH1A1HPGD | |
| SCHEMBL449665 | 0.82 | TDP1 (0.70) | HSD17B10KDM4ETDP1ALDH1A1HPGD | |
| Bromide SCHEMBL11670638 | 0.81 | TDP1 (0.68) | HSD17B10KDM4ETDP1ALDH1A1HPGD | |
| SCHEMBL12498905 | 0.80 | HSD17B10 (0.51) | HSD17B10KDM4ETDP1ALDH1A1HPGD | |
| SCHEMBL30468550 | 0.80 | HSD17B10 (0.51) | HSD17B10KDM4ETDP1ALDH1A1HPGD |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4257947-A | INTERMEDIATES FOR ANTIBACTERIAL CEPHALOSPORINS | SMITHKLINE CORPORATION (US) | 1981-03-24 | — | — | US | disclosed |
| US-4236001-A | 7β-Acyloxy-3-heterocyclicthiomethyl cephalosporins | SMITHKLINE CORPORATION (US) | 1980-11-25 | — | — | US | disclosed |
| US-4218564-A | 7β-Hydroxy-3-heterocyclicthio-methyl cephalosporin intermediates | SMITHKLINE CORPORATION (US) | 1980-08-19 | — | — | US | disclosed |
| US-4166816-A | CYCLIZATION | SMITHKLINE CORPORATION (US) | 1979-09-04 | — | — | US | disclosed |
| US-4158733-A | 7β-Acyloxy-3-acetoxymethyl cephalosporins | SMITHKLINE CORPORATION (US) | 1979-06-19 | — | — | US | disclosed |
| US-4131734-A | 7β-Acyloxy-3-heterocyclicthiomethyl cephalosporins | SMITHKLINE CORPORATION (US) | 1978-12-26 | — | — | US | disclosed |
| US-4103086-A | 8-Oxo-4-thia-1-azabicyclo (4.2.0)-oct-2-ene derivatives | SMITHKLINE CORPORATION (US) | 1978-07-25 | — | — | US | disclosed |
| US-4072674-A | FOR CEPHALOSPORIN CONGENERS | SMITHKLINE CORPORATION (US) | 1978-02-07 | — | — | US | disclosed |
| US-4020057-A | 7β-Acyloxy cephalosporins | SMITHKLINE CORPORATION (US) | 1977-04-26 | — | — | US | disclosed |