Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19952979 | 0.80 | PDE4A (0.59) | PDE4ALMNATDP1USP2SLCO1B1 | |
| SCHEMBL3067831 | 0.80 | PDE4A (0.59) | PDE4ALMNATDP1USP2SLCO1B1 | |
| SCHEMBL288150 | 0.80 | PDE4A (0.59) | PDE4ALMNATDP1USP2SLCO1B1 | |
| SCHEMBL258100 | 0.80 | PDE4A (0.59) | PDE4ALMNATDP1USP2SLCO1B1 | |
| SCHEMBL19952978 | 0.80 | PDE4A (0.59) | PDE4ALMNATDP1USP2SLCO1B1 | |
| SCHEMBL29563836 | 0.80 | PDE4A (0.59) | PDE4ALMNATDP1USP2SLCO1B1 | |
| SCHEMBL27958249 | 0.77 | PDE4A (0.47) | PDE4ALMNATDP1USP2SLCO1B1 | |
| SCHEMBL2135451 | 0.77 | PDE4A (0.55) | PDE4ALMNATDP1USP2SLCO1B1 | |
| SCHEMBL887710 | 0.77 | PDE4A (0.55) | PDE4ALMNATDP1USP2SLCO1B1 | |
| SCHEMBL2987563 | 0.76 | PDE4A (0.46) | PDE4ALMNATDP1USP2SLCO1B1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7527934-B2 | Labeled substrate conjugates for identifying enzyme inhibitors | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2009-05-05 | — | — | US | disclosed |
| US-20060057658-A1 | Labeled substrate conjugates for identifying enzyme inhibitors | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2006-03-16 | — | — | US | disclosed |