Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 7/20 | 0.64 |
| ▸ | MAPT | P10636 | 5/20 | 0.64 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.64 |
| ▸ | ACHE | P22303 | 1/20 | 0.63 |
| ▸ | BACE1 | P56817 | 1/20 | 0.63 |
| ▸ | MEN1 | O00255 | 3/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.61 |
| ▸ | APP | P05067 | 1/20 | 0.61 |
| ▸ | XDH | P47989 | 1/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | HPGD | P15428 | 2/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL997836 | 1.00 | ABCG2 (0.64) | ABCG2MAPTTNFRSF1AACHEBACE1 | |
| SCHEMBL997363 | 0.90 | ABCG2 (0.67) | ABCG2MAPTTNFRSF1AACHEBACE1 | |
| SCHEMBL997364 | 0.90 | ABCG2 (0.67) | ABCG2MAPTTNFRSF1AACHEBACE1 | |
| SCHEMBL998254 | 0.88 | ABCG2 (0.67) | ABCG2MAPTTNFRSF1AACHEBACE1 | |
| SCHEMBL998256 | 0.88 | ABCG2 (0.67) | ABCG2MAPTTNFRSF1AACHEBACE1 | |
| SCHEMBL25238512 | 0.82 | ACHE (0.81) | ABCG2MAPTTNFRSF1AACHEBACE1 | |
| SCHEMBL996875 | 0.81 | ABCG2 (0.56) | ABCG2MAPTTNFRSF1AACHEBACE1 | |
| SCHEMBL996877 | 0.81 | ABCG2 (0.56) | ABCG2MAPTTNFRSF1AACHEBACE1 | |
| SCHEMBL996825 | 0.79 | ABCG2 (0.64) | ABCG2MAPTTNFRSF1AALDH1A1HPGD | |
| SCHEMBL996824 | 0.79 | ABCG2 (0.64) | ABCG2MAPTTNFRSF1AALDH1A1HPGD |
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-2011009826-A2 | NOVEL CHALCONE DERIVATIVES WITH CYTOTOXIC ACTIVITY | ADAMED Sp.z o.o. (PL) | 2011-01-27 | — | — | WO | disclosed |