Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 4/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 4/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1266982 | 0.94 | MAPT (0.47) | MAPTMEN1KMT2AHTTKDM4E | |
| SCHEMBL1267472 | 0.88 | ALDH1A1 (0.52) | MAPTMEN1KMT2AHTTKDM4E | |
| SCHEMBL1266335 | 0.87 | ALDH1A1 (0.47) | MAPTMEN1KMT2AHTTKDM4E | |
| SCHEMBL1265994 | 0.85 | MEN1 (0.55) | MAPTMEN1KMT2AHTTKDM4E | |
| SCHEMBL4781278 | 0.83 | ALDH1A1 (0.38) | MAPTMEN1KMT2AHTTKDM4E | |
| SCHEMBL4783560 | 0.82 | SMN1; SMN2 (0.45) | MAPTMEN1KMT2AHTTKDM4E | |
| SCHEMBL1266157 | 0.81 | TP53 (0.45) | MAPTMEN1KMT2AHTTKDM4E | |
| SCHEMBL4781085 | 0.79 | TACR1 (0.40) | KDM4EALDH1A1HSP90AA1HSP90AB1L3MBTL1 | |
| SCHEMBL1266343 | 0.79 | ALDH1A1 (0.52) | MAPTMEN1KMT2AHTTKDM4E | |
| SCHEMBL1267519 | 0.76 | MAPT (0.60) | MAPTMEN1KMT2AHTTKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008067222-A1 | HETEROCYCLIC MODULATORS OF TGR5 | KALYPSYS, INC. (US) | 2008-06-05 | — | — | WO | disclosed |
| WO-2008067222-A1 | HETEROCYCLIC MODULATORS OF TGR5 | KALYPSYS, INC. (US) | 2008-06-05 | — | — | WO | disclosed |