Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.50 |
| ▸ | ROCK2 | O75116 | 6/20 | 0.46 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.46 |
| ▸ | PPARG | P37231 | 1/20 | 0.46 |
| ▸ | MMP13 | P45452 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.43 |
| ▸ | VNN1 | O95497 | 1/20 | 0.43 |
| ▸ | GRM5 | P41594 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7458374 | 0.93 | GAA (0.56) | GAACHRM3ROCK2ROCK1PPARG | |
| SCHEMBL7375760 | 0.86 | GAA (0.67) | GAAROCK2EPHX2RAB9AGPR139 | |
| SCHEMBL6881434 | 0.84 | FFAR1 (0.52) | GAAPPARG | |
| SCHEMBL7380693 | 0.82 | F10 (0.51) | ROCK2PPARGMMP13EPHX2LMNA | |
| SCHEMBL7862007 | 0.80 | MMP13 (0.47) | ROCK2ROCK1PPARGMMP13EPHX2 | |
| SCHEMBL7861961 | 0.80 | SENP1 (0.49) | ROCK2PPARGMMP13EPHX2LMNA | |
| SCHEMBL7862004 | 0.80 | MMP13 (0.47) | ROCK2ROCK1PPARGMMP13EPHX2 | |
| SCHEMBL7380699 | 0.79 | PPARG (0.44) | GAAROCK2PPARGMMP13EPHX2 | |
| SCHEMBL7862050 | 0.79 | PPARG (0.44) | ROCK2PPARGMMP13EPHX2LMNA | |
| SCHEMBL7861953 | 0.78 | NAMPT (0.55) | PPARGLMNAHPGDRAB9A |
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-0889877-B1 | META-SUBSTITUTED PHENYLENE DERIVATIVES AND THEIR USE AS ALPHAvBETA3 INTEGRIN ANTAGONISTS OR INHIBITORS | SEARLE & CO (US) | 2001-08-29 | — | — | EP | disclosed |