Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 3/20 | 0.43 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 2/20 | 0.41 |
| ▸ | PPARD | Q03181 | 2/20 | 0.41 |
| ▸ | PPARA | Q07869 | 2/20 | 0.41 |
| ▸ | KMO | O15229 | 1/20 | 0.41 |
| ▸ | SLC22A12 | Q96S37 | 4/20 | 0.40 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.39 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.39 |
| ▸ | VNN1 | O95497 | 1/20 | 0.38 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.38 |
| ▸ | MGLL | Q99685 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.37 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5319300 | 0.98 | AKR1B1 (0.45) | AKR1B1TBXAS1PPARGPPARDPPARA | |
| SCHEMBL1051660 | 0.93 | AKR1B1 (0.45) | AKR1B1TBXAS1PPARGPPARDPPARA | |
| SCHEMBL5317347 | 0.92 | CYP1A2 (0.45) | AKR1B1TBXAS1PPARGPPARDPPARA | |
| SCHEMBL5318039 | 0.91 | AKR1B1 (0.43) | AKR1B1TBXAS1SLC22A12PTGER4MGLL | |
| SCHEMBL5316058 | 0.90 | KMO (0.44) | AKR1B1TBXAS1PPARGPPARDPPARA | |
| SCHEMBL5317751 | 0.90 | CYP1A2 (0.47) | AKR1B1TBXAS1PPARGPPARDPPARA | |
| SCHEMBL5320464 | 0.89 | AKR1B1 (0.45) | AKR1B1TBXAS1KMOSLC22A12PTGER4 | |
| SCHEMBL5318908 | 0.89 | NR1H2 (0.42) | AKR1B1SLC22A12PTGER4NR1H2NR1H3 | |
| SCHEMBL5318259 | 0.88 | KMO (0.46) | AKR1B1TBXAS1PPARGPPARDPPARA | |
| SCHEMBL5273263 | 0.88 | NR1H2 (0.41) | AKR1B1SLC22A12PTGER4NR1H2NR1H3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2502624-A1 | Lonidamine analogues and their use in male contraception and cancer treatment | THE UNIVERSITY OF KANSAS (US) | 2012-09-26 | — | — | EP | claimed |
| EP-1786424-A2 | LONIDAMINE ANALOGUES AND THEIR USE IN MALE CONTRACEPTION AND CANCER TREATMENT | The University of Kansas (US) | 2007-05-23 | — | — | EP | claimed |
| WO-2006023704-A2 | LONIDAMINE ANALOGUES AND THEIR USE IN MALE CONTRACEPTION AND CANCER TREATMENT | UNIVERSITY OF KANSAS (US) | 2006-03-02 | — | — | WO | claimed |