Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | CA12 | O43570 | 1/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | CA4 | P22748 | 1/20 | 0.51 |
| ▸ | CA9 | Q16790 | 1/20 | 0.51 |
| ▸ | MC5R | P33032 | 2/20 | 0.50 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | HTR2A | P28223 | 3/20 | 0.47 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.47 |
| ▸ | NQO2 | P16083 | 1/20 | 0.47 |
| ▸ | MPO | P05164 | 2/20 | 0.46 |
| ▸ | MC3R | P41968 | 1/20 | 0.45 |
| ▸ | MC1R | Q01726 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2343213 | 0.87 | HPGD (0.62) | HPGDCA12CA1CA2CA4 | |
| Hydrochloric Acid SCHEMBL3792222 | 0.86 | HPGD (0.60) | HPGDCA12CA1CA2CA4 | |
| SCHEMBL3991458 | 0.85 | HTR2A (0.54) | HPGDCA12CA1CA2CA4 | |
| SCHEMBL24821313 | 0.85 | HPGD (0.56) | HPGDCA12CA1CA2CA4 | |
| SCHEMBL3981271 | 0.81 | HPGD (0.63) | HPGDCA12CA1CA2CA4 | |
| SCHEMBL4159646 | 0.81 | HTR2A (0.56) | HPGDCA12CA1CA2CA4 | |
| SCHEMBL3982326 | 0.81 | HPGD (0.52) | HPGDCA12CA1CA2CA4 | |
| SCHEMBL3985765 | 0.81 | HPGD (0.52) | HPGDCA12CA1CA2CA4 | |
| SCHEMBL8826281 | 0.81 | LTA4H (0.58) | HPGDCA12CA1CA2CA4 | |
| SCHEMBL3991179 | 0.81 | MC5R (0.50) | HPGDCA12CA1CA2CA4 |
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-2061449-A1 | SUBSTITUTED ACETYLENIC COMPOUNDS USEFUL FOR THE TREATMENT OF DISEASES | Leo Pharma A/S (DK) | 2009-05-27 | — | — | EP | disclosed |
| WO-2008019690-A1 | SUBSTITUTED ACETYLENIC COMPOUNDS USEFUL FOR THE TREATMENT OF DISEASES | LEO PHARMA A/S (DK) | 2008-02-21 | — | — | WO | disclosed |