Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.45 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.44 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.44 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | ABL1 | P00519 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30457019 | 0.91 | SLC6A2 (0.48) | CA12CA1CA9NPSR1LMNA | |
| SCHEMBL6027823 | 0.91 | SLC6A2 (0.48) | CA12CA1CA9NPSR1LMNA | |
| SCHEMBL8615953 | 0.88 | CA1 (0.59) | CA12CA1CA9ALDH1A1RECQL | |
| SCHEMBL24962598 | 0.87 | HDAC1 (0.47) | NPSR1LMNAL3MBTL1NCEH1PDE3B | |
| SCHEMBL9805741 | 0.87 | HDAC1 (0.47) | NPSR1LMNAL3MBTL1NCEH1PDE3B | |
| SCHEMBL30754667 | 0.87 | HDAC1 (0.47) | NPSR1LMNAL3MBTL1NCEH1PDE3B | |
| SCHEMBL24961871 | 0.87 | HDAC1 (0.47) | NPSR1LMNAL3MBTL1NCEH1PDE3B | |
| SCHEMBL4594840 | 0.87 | HDAC1 (0.47) | NPSR1LMNAL3MBTL1NCEH1PDE3B | |
| SCHEMBL30457219 | 0.87 | HDAC1 (0.47) | NPSR1LMNAL3MBTL1NCEH1PDE3B | |
| SCHEMBL30754663 | 0.87 | HDAC1 (0.47) | NPSR1LMNAL3MBTL1NCEH1PDE3B |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6730242-B2 | EFFICIENCY | THE UNIVERSITY OF ROCHESTER | 2004-05-04 | — | — | US | disclosed |
| US-20030164473-A1 | Glass-forming liquid crystalline compositions and optical devices formed therefrom | NATIONAL SCIENCE FOUNDATION | 2003-09-04 | — | — | US | disclosed |
| US-6558572-B2 | Optical device | UNIVERSITY OF ROCHESTER | 2003-05-06 | — | — | US | disclosed |
| US-20010036517-A1 | Glass-forming liquid crystalline compositions and optical devices formed therefrom | NATIONAL SCIENCE FOUNDATION | 2001-11-01 | — | — | US | disclosed |