Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | RGS12 | O14924 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.46 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | PLA2G2A | P14555 | 5/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL2996573 | 0.96 | FAAH (0.49) | FAAHMAPTLMNACYP3A4CYP2C9 | |
| SCHEMBL3001471 | 0.96 | FAAH (0.54) | FAAHMAPTKMT2AMEN1RGS12 | |
| SCHEMBL4378535 | 0.89 | FAAH (0.52) | FAAHMAPTKMT2AMEN1RGS12 | |
| SCHEMBL4386918 | 0.88 | PTGS2 (0.53) | FAAHMAPTKMT2AMEN1RGS12 | |
| SCHEMBL3004659 | 0.88 | PTGS2 (0.53) | FAAHMAPTKMT2AMEN1RGS12 | |
| SCHEMBL4094533 | 0.88 | FAAH (0.53) | FAAHMAPTKMT2AMEN1RGS12 | |
| SCHEMBL2994594 | 0.88 | FAAH (0.64) | FAAHMAPTKMT2AMEN1RGS12 | |
| SCHEMBL3000444 | 0.87 | FAAH (0.47) | FAAHKMT2ACYP3A4CYP2C9PTGS2 | |
| SCHEMBL3001645 | 0.86 | LMNA (0.40) | FAAHMAPTKMT2AMEN1ALDH1A1 | |
| SCHEMBL3006639 | 0.86 | FAAH (0.51) | FAAHMAPTKMT2AMEN1RGS12 |
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 |