Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 3/20 | 0.35 |
| ▸ | SLC22A12 | Q96S37 | 8/20 | 0.33 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.33 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6233930 | 0.92 | KIF11 (0.40) | KIF11SLC22A12APOBEC3GKCNA5CYP1A2 | |
| SCHEMBL2643304 | 0.76 | — | — | |
| SCHEMBL864206 | 0.73 | APOBEC3G (0.55) | KIF11APOBEC3G | |
| SCHEMBL6238584 | 0.64 | ALDH1A1 (0.44) | KIF11APOBEC3GCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL1769946 | 0.62 | CYP11B2 (0.53) | SLC22A12KCNA5CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL3078934 | 0.61 | SLC22A12 (0.43) | SLC22A12 | |
| SCHEMBL7557430 | 0.60 | KCNA5 (0.42) | KIF11KCNA5CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL17318488 | 0.60 | SCN9A (0.40) | KIF11 | |
| SCHEMBL29900474 | 0.59 | AOC1 (0.43) | — | |
| SCHEMBL6249306 | 0.59 | AOC1 (0.43) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1222194-A1 | 7-ACYLAMINO-3-HETEROARYLTHIO-3-CEPHEM CARBOXYLIC ACID ANTIBIOTICS AND PRODRUGS THEREOF | Essential Therapeutics, Inc. (US) | 2002-07-17 | — | — | EP | disclosed |
| WO-2001021623-A1 | 7-ACYLAMINO-3-HETEROARYLTHIO-3-CEPHEM CARBOXYLIC ACID ANTIBIOTICS AND PRODRUGS THEREOF | ESSENTIAL THERAPEUTICS, INC. (US) | 2001-03-29 | — | — | WO | disclosed |