Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA3 | P22001 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | RGS12 | O14924 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.43 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29136189 | 0.92 | MAPT (0.47) | KCNA3MAPTALDH1A1LMNAMEN1 | |
| SCHEMBL2117424 | 0.87 | HTR6 (0.48) | KCNA3MAPTALDH1A1LMNATSHR | |
| SCHEMBL29136213 | 0.84 | CCR2 (0.51) | MAPTLMNAMEN1TSHRKMT2A | |
| SCHEMBL15062690 | 0.84 | IDO1 (0.39) | MAPTLMNAMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL4377626 | 0.81 | CACNB4 (0.45) | MAPTALDH1A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL22632586 | 0.79 | HTR6 (0.43) | MAPTALDH1A1MEN1TSHRKMT2A | |
| SCHEMBL3091133 | 0.78 | P2RX4 (0.48) | MAPTALDH1A1LMNAMAPK1TP53 | |
| SCHEMBL6235287 | 0.75 | GRM2 (0.46) | MAPTALDH1A1MEN1TSHRKMT2A | |
| SCHEMBL6087656 | 0.75 | HDAC8 (0.57) | KCNA3MAPTLMNATP53CCR2 | |
| SCHEMBL29136198 | 0.75 | MAPT (0.46) | MAPTALDH1A1LMNAMEN1PKM |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2610244-A1 | Indole compounds | Ironwood Pharmaceuticals, Inc. (US) | 2013-07-03 | — | — | EP | disclosed |
| 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 |