Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TUBB1 | Q9H4B7 | 5/20 | 0.51 |
| ▸ | TNFRSF1A | P19438 | 2/20 | 0.51 |
| ▸ | BCHE | P06276 | 3/20 | 0.46 |
| ▸ | ACHE | P22303 | 2/20 | 0.46 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.44 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.43 |
| ▸ | TUBB | P07437 | 2/20 | 0.43 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.43 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.43 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.43 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.43 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.43 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.43 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.43 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.43 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.43 |
| ▸ | TUBA1C | Q9BQE3 | 2/20 | 0.43 |
| ▸ | TUBB6 | Q9BUF5 | 2/20 | 0.43 |
| ▸ | TUBB2B | Q9BVA1 | 2/20 | 0.43 |
| ▸ | SYK | P43405 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4847787 | 1.00 | TUBB1 (0.51) | TUBB1TNFRSF1ABCHEACHEMCL1 | |
| SCHEMBL4847316 | 0.91 | MCL1 (0.48) | TUBB1TNFRSF1ABCHEACHEMCL1 | |
| SCHEMBL4851370 | 0.91 | MCL1 (0.48) | TUBB1TNFRSF1ABCHEACHEMCL1 | |
| SCHEMBL4847824 | 0.89 | TUBB1 (0.55) | TUBB1TNFRSF1ABCHEACHEMCL1 | |
| SCHEMBL4853445 | 0.89 | TUBB1 (0.55) | TUBB1TNFRSF1ABCHEACHEMCL1 | |
| SCHEMBL4847429 | 0.89 | BCHE (0.46) | TNFRSF1ABCHEACHESYKMEN1 | |
| SCHEMBL4849953 | 0.89 | BCHE (0.46) | TNFRSF1ABCHEACHESYKMEN1 | |
| SCHEMBL6141442 | 0.89 | MAOA (0.46) | TUBB1BCHEACHETUBB4ATUBB | |
| SCHEMBL4856235 | 0.89 | MAOA (0.46) | TUBB1BCHEACHETUBB4ATUBB | |
| SCHEMBL4854085 | 0.88 | ABCG2 (0.51) | TNFRSF1ABCHEACHEMEN1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7423181-B2 | in particular against bacterial and parasitic infections, fungi, and helminths; improved metabolic and physiochemical properties, bioavailability, solubility; 3-[4-(2-Dimethylamino-ethoxy)-2'-trifluoromethyl-biphenyl-3-yl]-1-(2-dimethylaminomethyl-phenyl)-propenone | LICA PHARMACEUTICALS A/S (DK) | 2008-09-09 | — | — | US | disclosed |
| US-20050227990-A1 | Aminoalkoxy-functional chalcones | LICA PHARMACEUTICALS A/S (DK) | 2005-10-13 | — | — | US | disclosed |