Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.59 |
| ▸ | HTT | P42858 | 2/20 | 0.53 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.47 |
| ▸ | CHKA | P35790 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.42 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 2/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30341108 | 0.83 | ALDH1A1 (0.73) | KDM4ESMN1; SMN2ALDH1A1HTTHRH3 | |
| SCHEMBL9755664 | 0.81 | LMNA (0.47) | KDM4ESMN1; SMN2ALDH1A1HRH3MEN1 | |
| SCHEMBL6803849 | 0.81 | ALDH1A1 (0.70) | KDM4ESMN1; SMN2ALDH1A1HTTHRH3 | |
| SCHEMBL16198768 | 0.77 | BDKRB1 (0.46) | KDM4ESMN1; SMN2ALDH1A1HTTHRH3 | |
| SCHEMBL31010076 | 0.77 | KDM4E (0.70) | KDM4ESMN1; SMN2ALDH1A1HTTMEN1 | |
| SCHEMBL21794075 | 0.76 | KDM4E (0.74) | KDM4ESMN1; SMN2ALDH1A1HTTHRH3 | |
| SCHEMBL30596583 | 0.76 | KDM4E (0.74) | KDM4ESMN1; SMN2ALDH1A1HTTHRH3 | |
| SCHEMBL30341003 | 0.76 | KDM4E (1.00) | KDM4ESMN1; SMN2ALDH1A1HTTHRH3 | |
| SCHEMBL807350 | 0.74 | ALDH1A1 (1.00) | KDM4ESMN1; SMN2ALDH1A1HTTMEN1 | |
| SCHEMBL3377345 | 0.74 | MPO (0.56) | KDM4ESMN1; SMN2ALDH1A1HRH3TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012082947-A1 | COMPOUNDS AND COMPOSITIONS AS TGR5 AGONISTS | IRM LLC (BM) | 2012-06-21 | — | — | WO | claimed |