Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | GRM5 | P41594 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4781278 | 0.92 | ALDH1A1 (0.38) | SMN1; SMN2ALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL1267017 | 0.84 | ALDH1A1 (0.53) | SMN1; SMN2ALDH1A1GAAHPGDMEN1 | |
| SCHEMBL4781085 | 0.82 | TACR1 (0.40) | ALDH1A1KDM4ECYP3A4L3MBTL1 | |
| SCHEMBL4783251 | 0.82 | MAPT (0.41) | ALDH1A1MEN1KMT2AKDM4ELMNA | |
| SCHEMBL1265985 | 0.82 | GRIN2C (0.45) | SMN1; SMN2ALDH1A1GAAMEN1KMT2A | |
| SCHEMBL1266365 | 0.79 | ALDH1A1 (0.58) | SMN1; SMN2ALDH1A1GAAHPGDMEN1 | |
| SCHEMBL1267009 | 0.78 | ALDH1A1 (0.48) | SMN1; SMN2ALDH1A1GAAMEN1KMT2A | |
| SCHEMBL1266335 | 0.78 | ALDH1A1 (0.47) | SMN1; SMN2ALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL4783442 | 0.77 | MAPT (0.47) | SMN1; SMN2ALDH1A1GAAMEN1KMT2A | |
| SCHEMBL1266982 | 0.76 | MAPT (0.47) | SMN1; SMN2ALDH1A1MEN1KMT2AKDM4E |
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 |