Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | PDE2A | O00408 | 1/20 | 0.33 |
| ▸ | PDE6D | O43924 | 1/20 | 0.33 |
| ▸ | PDE8A | O60658 | 1/20 | 0.33 |
| ▸ | PDE5A | O76074 | 1/20 | 0.33 |
| ▸ | PDE9A | O76083 | 1/20 | 0.33 |
| ▸ | PDE8B | O95263 | 1/20 | 0.33 |
| ▸ | PDE6A | P16499 | 1/20 | 0.33 |
| ▸ | PDE6G | P18545 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14060874 | 0.70 | PDE2A (0.36) | PARP1PDE2APDE6DPDE8APDE5A | |
| SCHEMBL232090 | 0.69 | PNP (0.37) | PARP1PDE2APDE6DPDE8APDE5A | |
| SCHEMBL12638629 | 0.69 | PARP1 (0.41) | PARP1PDE2APDE6DPDE8APDE5A | |
| SCHEMBL3420036 | 0.68 | PDE3B (0.36) | PDE2APDE6DPDE8APDE5APDE9A | |
| SCHEMBL24932075 | 0.65 | TP53 (0.41) | PARP1ALDH1A1PDE2APDE6DPDE8A | |
| SCHEMBL24931693 | 0.64 | PDE3B (0.42) | SMN1; SMN2LMNAALDH1A1PDE3BPDE3A | |
| SCHEMBL24222070 | 0.64 | PDE2A (0.33) | XDHPDE2APDE6DPDE8APDE5A | |
| SCHEMBL2450155 | 0.62 | PDE3B (0.37) | PDE2APDE6DPDE8APDE5APDE9A | |
| SCHEMBL232091 | 0.62 | PDE4A (0.47) | ADORA2ABLMALDH1A1PDE2APDE6D | |
| SCHEMBL7700737 | 0.61 | PDE3B (0.39) | XDHPDE2APDE6DPDE8APDE5A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010065149-A1 | ORGANIC COMPOUNDS | INTRA-CELLULAR THERAPIES, INC. (US) | 2010-06-10 | — | — | WO | claimed |
| EP-2367429-B1 | ORGANIC COMPOUNDS | INTRA CELLULAR THERAPIES INC (US) | 2017-06-07 | — | — | EP | disclosed |
| CN-102231953-A | Organic compounds | INTRA CELLULAR THERAPIES INC | 2011-11-02 | — | — | CN | disclosed |
| WO-2010065149-A1 | ORGANIC COMPOUNDS | INTRA-CELLULAR THERAPIES, INC. (US) | 2010-06-10 | — | — | WO | disclosed |