Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLA2G2A | P14555 | 4/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE11A | Q9HCR9 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | RGS12 | O14924 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | GNAI1 | P63096 | 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 | |
|---|---|---|---|---|
| SCHEMBL2004327 | 0.94 | F2RL3 (0.34) | PLA2G2APDE4BPDE11AMAPTCYP3A4 | |
| SCHEMBL2003824 | 0.93 | LMNA (0.33) | GSK3BPDE4BPDE11AMAPTCYP1A2 | |
| SCHEMBL2004842 | 0.91 | FAAH (0.33) | PTGDR2PDE4BPDE11AMAPTALDH1A1 | |
| SCHEMBL2007916 | 0.91 | LMNA (0.41) | PLA2G2APTGS2MAPTCYP1A2CYP3A4 | |
| SCHEMBL2003372 | 0.91 | PLA2G2A (0.38) | PLA2G2APTGS2PTGDR2GSK3BMAPT | |
| SCHEMBL2002081 | 0.91 | L3MBTL1 (0.35) | PDE4BPDE11AMAPTALDH1A1LMNA | |
| SCHEMBL2005382 | 0.90 | PLA2G2A (0.38) | PLA2G2APTGDR2GSK3BMAPTCYP1A2 | |
| SCHEMBL2007059 | 0.90 | MAPK1 (0.41) | PLA2G2APTGS2PTGDR2GSK3BPDE4B | |
| SCHEMBL2008174 | 0.90 | PLA2G2A (0.42) | PLA2G2APTGDR2MAPTCYP1A2CYP3A4 | |
| SCHEMBL2010346 | 0.89 | PLA2G2A (0.37) | PLA2G2APTGS2PTGDR2GSK3BMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-7960544-B2 | Useful indole compounds | IRONWOOD PHARMACEUTICALS, INC. (US) | 2011-06-14 | — | — | US | disclosed |