Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFKB1 | P19838 | 2/20 | 0.59 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.59 |
| ▸ | JUN | P05412 | 1/20 | 0.59 |
| ▸ | CA1 | P00915 | 1/20 | 0.58 |
| ▸ | CA2 | P00918 | 1/20 | 0.58 |
| ▸ | CA4 | P22748 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 4/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | BCHE | P06276 | 1/20 | 0.53 |
| ▸ | GUSB | P08236 | 1/20 | 0.53 |
| ▸ | IAPP | P10997 | 3/20 | 0.49 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | BACE1 | P56817 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | ALPL | P05186 | 1/20 | 0.46 |
| ▸ | ALPI | P09923 | 1/20 | 0.46 |
| ▸ | ALPG | P10696 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL3508745 | 0.91 | NFKB1 (0.70) | NFKB1NFE2L2JUNCA1CA2 | |
| SCHEMBL3508748 | 0.91 | NFKB1 (0.70) | NFKB1NFE2L2JUNCA1CA2 | |
| SCHEMBL10348522 | 0.84 | NFKB1 (0.65) | NFKB1NFE2L2JUNCA1CA2 | |
| SCHEMBL10348521 | 0.84 | NFKB1 (0.65) | NFKB1NFE2L2JUNCA1CA2 | |
| SCHEMBL16576811 | 0.83 | NFKB1 (0.70) | NFKB1NFE2L2JUNCA1CA2 | |
| SCHEMBL10448404 | 0.80 | NFKB1 (0.78) | NFKB1NFE2L2JUNCA1CA2 | |
| SCHEMBL10448403 | 0.80 | NFKB1 (0.78) | NFKB1NFE2L2JUNCA1CA2 | |
| SCHEMBL3213881 | 0.80 | BACE1 (0.72) | BACE1 | |
| SCHEMBL8467370 | 0.80 | MAPT (0.57) | NFKB1NFE2L2JUNCA1CA2 | |
| SCHEMBL3213868 | 0.80 | BACE1 (0.72) | BACE1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7521580-B1 | Non-cytotoxic synthetic analogues of (1E, 6E)-1, 7-Bis (4-hydroxy-3-methoxyphenyl)-1, 6-heptadiene-3, 5-Dione and therapeutic applications thereof in cystic fibrosis | SAMI LABS LTD. (IN) | 2009-04-21 | — | — | US | disclosed |