Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 4/20 | 0.41 |
| ▸ | TNF | P01375 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 2/20 | 0.37 |
| ▸ | SRC | P12931 | 2/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 2/20 | 0.35 |
| ▸ | PRKCB | P05771 | 1/20 | 0.35 |
| ▸ | PRKCA | P17252 | 1/20 | 0.35 |
| ▸ | PRKCH | P24723 | 1/20 | 0.35 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.35 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.35 |
| ▸ | TNFSF11 | O14788 | 1/20 | 0.35 |
| ▸ | POLR1A | O95602 | 1/20 | 0.35 |
| ▸ | TACR1 | P25103 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL366300 | 0.88 | CNR2 (0.38) | PARP1TNFALDH1A1HPGDEGFR | |
| SCHEMBL366186 | 0.84 | ALDH1A1 (0.39) | ALDH1A1HPGDEGFRSRCHDAC1 | |
| SCHEMBL364305 | 0.84 | ALDH1A1 (0.36) | ALDH1A1HPGDEGFRSRCHDAC1 | |
| SCHEMBL366838 | 0.81 | ALDH1A1 (0.41) | ALDH1A1HPGDEGFRSRCHDAC1 | |
| SCHEMBL365487 | 0.81 | POLR1A (0.40) | PARP1TNFALDH1A1HPGDPOLR1A | |
| SCHEMBL366239 | 0.81 | PLA2G2A (0.41) | ALDH1A1HPGDCNR2PRKCBPRKCA | |
| SCHEMBL364862 | 0.81 | EGFR (0.56) | ALDH1A1HPGDEGFRSRCHDAC1 | |
| SCHEMBL364892 | 0.81 | ALDH1A1 (0.47) | PARP1TNFALDH1A1 | |
| SCHEMBL367569 | 0.80 | SRC (0.46) | ALDH1A1HPGDEGFRSRC | |
| SCHEMBL365762 | 0.80 | ALDH1A1 (0.44) | ALDH1A1HPGDUTS2R |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012007007-A1 | INHIBITORS OF HDME | EPITHERAPEUTICS APS (DK) | 2012-01-19 | — | — | WO | claimed |
| WO-2012007007-A1 | INHIBITORS OF HDME | EPITHERAPEUTICS APS (DK) | 2012-01-19 | — | — | WO | disclosed |