Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.36 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.36 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.35 |
| ▸ | PDE5A | O76074 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10143826 | 0.72 | PDE4D (0.46) | PDE4APDE4BPDE4CPDE4DKMT2A | |
| SCHEMBL5148402 | 0.68 | MEN1 (0.60) | KMT2AMEN1RAB9ANPC1USP2 | |
| SCHEMBL28034904 | 0.67 | NPC1 (0.59) | KMT2AMEN1RAB9ANPC1HPGD | |
| SCHEMBL13175546 | 0.67 | HTR4 (0.69) | PDE4APDE4BPDE4CPDE4DKMT2A | |
| SCHEMBL13175829 | 0.67 | NPC1 (0.67) | KMT2AMEN1RAB9ANPC1KDM4E | |
| SCHEMBL11315443 | 0.67 | NPC1 (0.60) | KMT2AMEN1RAB9ANPC1USP2 | |
| SCHEMBL13175544 | 0.66 | TDP1 (0.69) | KMT2AMEN1HTR4HPGDLMNA | |
| SCHEMBL14452805 | 0.66 | HTR4 (0.48) | PDE4APDE4BPDE4CPDE4DKMT2A | |
| SCHEMBL18993437 | 0.66 | MEN1 (0.54) | KMT2AMEN1RAB9ANPC1USP2 | |
| SCHEMBL359029 | 0.65 | MEN1 (0.68) | PDE4APDE4BPDE4CPDE4DKMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2079743-B1 | PTERIDINE DERIVATIVES AS POLO-LIKE KINASE INHIBITORS USEFUL IN THE TREATMENT OF CANCER | CHROMA THERAPEUTICS LTD (GB) | 2012-01-25 | — | — | EP | disclosed |