Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | HCAR2 | Q8TDS4 | 5/20 | 0.49 |
| ▸ | ALPL | P05186 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | DDO | Q99489 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18247723 | 0.86 | L3MBTL1 (0.53) | MEN1KMT2AL3MBTL1CYP1A2CYP2C9 | |
| SCHEMBL18247535 | 0.83 | ATM (0.53) | KDM4EALDH1A1ALPLL3MBTL1CYP1A2 | |
| Trifluoroacetic Acid SCHEMBL30325510 | 0.82 | ATM (0.49) | KDM4EALDH1A1ALPLL3MBTL1CYP1A2 | |
| SCHEMBL10781476 | 0.81 | ALDH1A1 (0.58) | KDM4EALDH1A1HCAR2ALPLMEN1 | |
| SCHEMBL3200467 | 0.80 | MEN1 (0.53) | MEN1KMT2APOLBLMNAL3MBTL1 | |
| SCHEMBL18247763 | 0.79 | L3MBTL1 (0.44) | HCAR2MEN1KMT2AL3MBTL1CYP1A2 | |
| SCHEMBL18247773 | 0.78 | SMN1; SMN2 (0.48) | HCAR2L3MBTL1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL15373443 | 0.78 | GAA (0.43) | KDM4EALDH1A1HCAR2MEN1KMT2A | |
| SCHEMBL2884033 | 0.78 | AR (0.52) | MEN1KMT2ALMNAL3MBTL1CYP2C9 | |
| SCHEMBL185842 | 0.77 | KDM4E (0.68) | KDM4EALDH1A1HCAR2ALPLMEN1 |
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-2011060199-A1 | BORON-CONTAINING SMALL MOLECULES | ANACOR PHARMACEUTICALS, INC. (US) | 2011-05-19 | — | — | WO | disclosed |