Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P4HB | P07237 | 7/20 | 0.57 |
| ▸ | BCHE | P06276 | 3/20 | 0.57 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.49 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.48 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL3692346 | 0.95 | BCHE (0.57) | P4HBBCHENR1H4USP2ABCG2 | |
| SCHEMBL3682839 | 0.95 | BCHE (0.57) | P4HBBCHENR1H4USP2ABCG2 | |
| SCHEMBL30384875 | 0.89 | BCHE (0.56) | P4HBBCHECYP1B1 | |
| SCHEMBL25184970 | 0.89 | BCHE (0.56) | P4HBBCHECYP1B1 | |
| SCHEMBL3691582 | 0.89 | BCHE (0.56) | P4HBBCHECYP1B1 | |
| SCHEMBL3690207 | 0.89 | BCHE (0.54) | BCHECYP1B1 | |
| SCHEMBL3687867 | 0.89 | BCHE (0.54) | BCHECYP1B1 | |
| SCHEMBL3691580 | 0.87 | BCHE (0.56) | P4HBBCHEABCG2CYP1B1 | |
| SCHEMBL3696162 | 0.87 | BCHE (0.56) | P4HBBCHEABCG2CYP1B1 | |
| SCHEMBL3687869 | 0.86 | BCHE (0.54) | BCHECYP1A2CYP1B1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20060235073-A1 | Diamino-functional chalcones | LICA PHARMACEUTICALS A/S (DK) | 2006-10-19 | — | — | US | claimed |
| US-7642367-B2 | Diamino-functional chalcones | LICA PHARMACEUTICALS A/S (DK) | 2010-01-05 | — | — | US | disclosed |
| US-20060235073-A1 | Diamino-functional chalcones | LICA PHARMACEUTICALS A/S (DK) | 2006-10-19 | — | — | US | disclosed |