Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLA2G2A | P14555 | 4/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | EDNRB | P24530 | 3/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | RGS12 | O14924 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3008414 | 0.97 | EPHX2 (0.40) | PLA2G2AEPHX2LMNASMN1; SMN2F2RL3 | |
| SCHEMBL3000840 | 0.95 | PLA2G2A (0.46) | PLA2G2AGSK3BEPHX2PTGS2LMNA | |
| SCHEMBL3003522 | 0.94 | EPHX2 (0.39) | PLA2G2AEPHX2LMNASMN1; SMN2F2RL3 | |
| SCHEMBL2992530 | 0.94 | EPHX2 (0.39) | PLA2G2AEPHX2LMNASMN1; SMN2F2RL3 | |
| SCHEMBL2998239 | 0.93 | MAPT (0.39) | PLA2G2AEPHX2LMNASMN1; SMN2MEN1 | |
| SCHEMBL2994490 | 0.92 | PLA2G2A (0.44) | PLA2G2AGSK3BEPHX2PTGS2LMNA | |
| SCHEMBL3005938 | 0.92 | PLA2G2A (0.44) | PLA2G2AGSK3BEPHX2PTGS2LMNA | |
| SCHEMBL3006204 | 0.92 | PLA2G2A (0.44) | PLA2G2AGSK3BEPHX2PTGS2LMNA | |
| SCHEMBL3004632 | 0.87 | PLA2G2A (0.41) | PLA2G2ALMNAMEN1RGS12ALDH1A1 | |
| SCHEMBL3001744 | 0.87 | SIGMAR1 (0.40) | EPHX2LMNAMEN1ALDH1A1MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2049520-A2 | INDOLE COMPOUNDS | Ironwood Pharmaceuticals, Inc. (US) | 2009-04-22 | — | — | EP | disclosed |
| WO-2008019357-A2 | INDOLE COMPOUNDS | IRONWOOD PHARMACEUTICALS, INC. (US) | 2008-02-14 | — | — | WO | disclosed |