Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | AKT1 | P31749 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL3343330 | 0.80 | LMNA (0.45) | MAPK1KDM4EHSD17B10ALDH1A1HPGD | |
| SCHEMBL3344033 | 0.79 | LMNA (0.47) | MAPK1KDM4EHSD17B10ALDH1A1HPGD | |
| SCHEMBL17629578 | 0.68 | LMNA (0.68) | KDM4EALDH1A1HPGDKMT2ASMN1; SMN2 | |
| SCHEMBL25664507 | 0.66 | GAA (0.57) | MAPK1KDM4EHSD17B10ALDH1A1KMT2A | |
| SCHEMBL5951427 | 0.66 | HCAR2 (0.44) | KDM4EALDH1A1KMT2AL3MBTL1HCAR2 | |
| SCHEMBL12818018 | 0.64 | MGAM (0.44) | HSD17B10ALDH1A1AKT1GAASMN1; SMN2 | |
| SCHEMBL5398985 | 0.63 | MAPK1 (0.64) | MAPK1ALDH1A1HPGDKMT2AGAA | |
| SCHEMBL10268198 | 0.63 | HRH3 (0.42) | KDM4EHSD17B10ALDH1A1HPGDKMT2A | |
| SCHEMBL6273007 | 0.62 | ALDH1A1 (0.45) | MAPK1KDM4EHSD17B10ALDH1A1HPGD | |
| SCHEMBL1564682 | 0.62 | SMN1; SMN2 (0.38) | ALDH1A1AKT1KMT2AGAAL3MBTL1 |
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-2516416-A1 | CRTH2 MODULATORS | Ironwood Pharmaceuticals, Inc. (US) | 2012-10-31 | — | — | EP | disclosed |
| WO-2012009134-A1 | CRTH2 MODULATORS | IRONWOOD PHARMACEUTICALS, INC. (US) | 2012-01-19 | — | — | WO | disclosed |
| WO-2011079007-A1 | CRTH2 MODULATORS | IRONWOOD PHARMACEUTICALS, INC. (US) | 2011-06-30 | — | — | WO | disclosed |