Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5135988 | 0.95 | DRD2 (0.40) | DRD2DRD4DRD3CA12CA1 | |
| SCHEMBL5137505 | 0.92 | DRD2 (0.39) | DRD2DRD4DRD3MEN1MAPT | |
| SCHEMBL20435262 | 0.86 | APP (0.47) | DRD2DRD4DRD3CA12CA1 | |
| SCHEMBL27589655 | 0.84 | HDAC4 (0.54) | CA12CA1CA2CA7CA9 | |
| SCHEMBL7264636 | 0.84 | DRD2 (0.35) | DRD2DRD4DRD3ALDH1A1KDM4E | |
| SCHEMBL7932656 | 0.78 | MEN1 (0.33) | DRD2DRD4DRD3ALDH1A1KDM4E | |
| SCHEMBL29993703 | 0.77 | CA1 (0.55) | DRD2DRD4DRD3CA12CA1 | |
| SCHEMBL236305 | 0.77 | CA1 (0.55) | DRD2DRD4DRD3CA12CA1 | |
| SCHEMBL28864507 | 0.77 | MAOA (0.46) | DRD2DRD4DRD3KDM4EMEN1 | |
| SCHEMBL9862309 | 0.76 | MEN1 (0.36) | ALDH1A1KDM4EMEN1MAPTKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1319231-A4 | PROGRAMMABLE MOLECULAR DEVICE | UNIV WM MARSH RICE (US) | 2008-11-19 | — | — | EP | disclosed |
| EP-1319231-A1 | PROGRAMMABLE MOLECULAR DEVICE | Wm. MARSH RICE UNIVERSITY (US) | 2003-06-18 | — | — | EP | disclosed |
| US-20030058697-A1 | Programmable molecular device | NAVY, SECRETARY OF THE, UNITED STATES OF AMERICA OFFICE OF NAVAL RESEARCH | 2003-03-27 | — | — | US | disclosed |
| WO-2002009117-A1 | PROGRAMMABLE MOLECULAR DEVICE | WM. MARSH RICE UNIVERSITY (US) | 2002-01-31 | — | — | WO | disclosed |