Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 2/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12414706 | 0.83 | HPGD (0.35) | HPGDTSHRNPSR1MEN1KMT2A | |
| SCHEMBL13667079 | 0.76 | ALDH1A1 (0.37) | TSHRALDH1A1LMNA | |
| SCHEMBL28124846 | 0.76 | KDM4E (0.50) | HPGDTSHRALDH1A1NPSR1MEN1 | |
| SCHEMBL10815654 | 0.75 | ALDH1A1 (0.47) | TSHRALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL805664 | 0.72 | HCAR2 (0.40) | TSHRALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL17617139 | 0.72 | HCAR2 (0.40) | TSHRALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL805650 | 0.72 | HCAR2 (0.40) | TSHRALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL20343849 | 0.71 | KMT2A (0.44) | HPGDTSHRALDH1A1NPSR1MEN1 | |
| SCHEMBL10056790 | 0.70 | KMT2A (0.46) | HPGDALDH1A1NPSR1MEN1KMT2A | |
| SCHEMBL15521662 | 0.70 | ACHE (0.39) | TSHRALDH1A1KMT2A |
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-2010149684-A1 | NEW COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS RELATING THERETO | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-12-29 | — | — | WO | disclosed |