Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 7/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.40 |
| ▸ | LMNA | P02545 | 7/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | RECQL | P46063 | 2/20 | 0.40 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.38 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.38 |
| ▸ | TUBB | P07437 | 1/20 | 0.38 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.38 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.38 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.38 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.38 |
| ▸ | TUBB3 | Q13509 | 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 | |
|---|---|---|---|---|
| SCHEMBL3687409 | 1.00 | NPC1 (0.41) | NPC1MEN1KMT2ALMNAALDH1A1 | |
| SCHEMBL3684393 | 0.91 | MAPT (0.45) | NPC1MEN1KMT2ALMNAALDH1A1 | |
| SCHEMBL3684395 | 0.91 | MAPT (0.45) | NPC1MEN1KMT2ALMNAALDH1A1 | |
| SCHEMBL3687288 | 0.85 | BCHE (0.42) | NPC1MEN1KMT2ALMNAALDH1A1 | |
| SCHEMBL3691047 | 0.80 | MEN1 (0.37) | NPC1MEN1KMT2ALMNAALDH1A1 | |
| SCHEMBL3691987 | 0.80 | LMNA (0.50) | MEN1KMT2ALMNAALDH1A1MAPT | |
| SCHEMBL3691989 | 0.80 | LMNA (0.50) | MEN1KMT2ALMNAALDH1A1MAPT | |
| SCHEMBL4856323 | 0.80 | LMNA (0.46) | NPC1MEN1KMT2ALMNAALDH1A1 | |
| SCHEMBL4856336 | 0.80 | LMNA (0.46) | NPC1MEN1KMT2ALMNAALDH1A1 | |
| SCHEMBL3686504 | 0.78 | HSP90AA1 (0.41) | MEN1KMT2AALDH1A1MAPT |
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 |