Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 1/20 | 0.44 |
| ▸ | SLC22A12 | Q96S37 | 4/20 | 0.44 |
| ▸ | PPARG | P37231 | 8/20 | 0.42 |
| ▸ | PPARA | Q07869 | 4/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | TACR2 | P21452 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 1/20 | 0.41 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5319585 | 0.95 | KMO (0.44) | KMOSLC22A12PPARGPPARAKCNH2 | |
| SCHEMBL5318197 | 0.91 | PTGDR2 (0.49) | KMOSLC22A12PPARGPPARAKCNH2 | |
| SCHEMBL5319646 | 0.91 | PPARG (0.49) | KMOSLC22A12PPARGCYP2C9PTGDR2 | |
| SCHEMBL5316549 | 0.90 | SLC22A12 (0.42) | KMOSLC22A12PPARGPPARAKCNH2 | |
| SCHEMBL5318343 | 0.89 | PPARG (0.38) | KMOPPARGPPARAKCNH2CYP2C9 | |
| SCHEMBL5271055 | 0.87 | PPARG (0.37) | PPARGPPARAKCNH2CYP2C9EGFR | |
| SCHEMBL5273572 | 0.87 | F2RL3 (0.40) | PPARGPPARAKCNH2CYP2C9EGFR | |
| SCHEMBL5316023 | 0.86 | PPARG (0.46) | KMOSLC22A12PPARGKCNH2CYP2C9 | |
| SCHEMBL5338753 | 0.86 | PPARG (0.36) | PPARGPPARAKCNH2CYP2C9EGFR | |
| SCHEMBL5346874 | 0.85 | PPARG (0.36) | PPARGPPARAKCNH2CYP2C9EGFR |
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 |