Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.60 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 5/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.55 |
| ▸ | RAB9A | P51151 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | APP | P05067 | 1/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | KCNQ1 | P51787 | 2/20 | 0.49 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.49 |
| ▸ | KDM1A | O60341 | 1/20 | 0.49 |
| ▸ | MAOA | P21397 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL4747404 | 1.00 | PARP1 (0.60) | PARP1GSTO1MAPTMAPK1RAB9A | |
| SCHEMBL4747406 | 1.00 | PARP1 (0.60) | PARP1GSTO1MAPTMAPK1RAB9A | |
| SCHEMBL4746969 | 0.97 | PARP1 (0.57) | PARP1GSTO1MAPTMAPK1RAB9A | |
| SCHEMBL4746972 | 0.97 | PARP1 (0.57) | PARP1GSTO1MAPTMAPK1RAB9A | |
| SCHEMBL4749732 | 0.97 | PARP1 (0.57) | PARP1GSTO1MAPTMAPK1RAB9A | |
| SCHEMBL4747592 | 0.96 | PARP1 (0.65) | PARP1GSTO1MAPTMAPK1RAB9A | |
| SCHEMBL4747595 | 0.96 | PARP1 (0.65) | PARP1GSTO1MAPTMAPK1RAB9A | |
| SCHEMBL4747601 | 0.96 | PARP1 (0.65) | PARP1GSTO1MAPTMAPK1RAB9A | |
| SCHEMBL4747612 | 0.95 | MAPT (0.57) | PARP1GSTO1MAPTMAPK1RAB9A | |
| SCHEMBL4747611 | 0.95 | MAPT (0.57) | PARP1GSTO1MAPTMAPK1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008124000-A2 | THIAZOLE DERIVATIVES AS ANDROGEN RECEPTOR MODULATOR COMPOUNDS | LIGAND PHARMACEUTICALS INCORPORATED (US) | 2008-10-16 | — | — | WO | claimed |