Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.38 |
| ▸ | CCR2 | P41597 | 1/20 | 0.38 |
| ▸ | SLC22A12 | Q96S37 | 4/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 3/20 | 0.35 |
| ▸ | KMO | O15229 | 1/20 | 0.34 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.34 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.34 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.34 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.34 |
| ▸ | GCGR | P47871 | 1/20 | 0.33 |
| ▸ | MC4R | P32245 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.33 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5317649 | 0.97 | AKR1B1 (0.38) | AKR1B1CCR2SLC22A12CYP2C9PTGDR2 | |
| SCHEMBL5317869 | 0.96 | AKR1B1 (0.37) | AKR1B1CCR2SLC22A12CYP2C9PTGDR2 | |
| SCHEMBL5270492 | 0.94 | AKR1B1 (0.39) | AKR1B1CCR2SLC22A12CYP2C9PTGDR2 | |
| SCHEMBL5316051 | 0.90 | NPSR1 (0.42) | AKR1B1CCR2SLC22A12CYP2C9NR1H2 | |
| SCHEMBL5318259 | 0.89 | KMO (0.46) | AKR1B1CCR2SLC22A12PTGDR2KMO | |
| SCHEMBL5320313 | 0.89 | NR1H2 (0.42) | AKR1B1CCR2SLC22A12CYP2C9NR1H2 | |
| SCHEMBL5316058 | 0.88 | KMO (0.44) | AKR1B1CCR2SLC22A12PTGDR2KMO | |
| SCHEMBL5322190 | 0.87 | NPSR1 (0.41) | AKR1B1CCR2SLC22A12CYP2C9NR1H2 | |
| SCHEMBL5317364 | 0.86 | NPSR1 (0.41) | AKR1B1CCR2SLC22A12CYP2C9NR1H2 | |
| SCHEMBL5318908 | 0.86 | NR1H2 (0.42) | AKR1B1CCR2SLC22A12CYP2C9NR1H2 |
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-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 |