Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 7/20 | 0.86 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.86 |
| ▸ | CYP19A1 | P11511 | 6/20 | 0.71 |
| ▸ | NQO2 | P16083 | 3/20 | 0.71 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.58 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.55 |
| ▸ | ESR1 | P03372 | 2/20 | 0.54 |
| ▸ | ABL1 | P00519 | 1/20 | 0.54 |
| ▸ | TTR | P02766 | 1/20 | 0.54 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.54 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.54 |
| ▸ | BCR | P11274 | 1/20 | 0.54 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.54 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.54 |
| ▸ | TUBB | P07437 | 1/20 | 0.54 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.54 |
| ▸ | AHR | P35869 | 1/20 | 0.54 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL4735253 | 0.93 | PTGS2 (1.00) | PTGS2PTGS1CYP19A1NQO2TLR9 | |
| SCHEMBL3392246 | 0.93 | PTGS2 (1.00) | PTGS2PTGS1CYP19A1NQO2TLR9 | |
| SCHEMBL4733440 | 0.93 | PTGS2 (1.00) | PTGS2PTGS1CYP19A1NQO2TLR9 | |
| SCHEMBL3359253 | 0.84 | CYP19A1 (1.00) | PTGS2PTGS1CYP19A1NQO2ESR1 | |
| SCHEMBL10277154 | 0.84 | CYP19A1 (1.00) | PTGS2PTGS1CYP19A1NQO2ESR1 | |
| SCHEMBL3359255 | 0.84 | CYP19A1 (1.00) | PTGS2PTGS1CYP19A1NQO2ESR1 | |
| SCHEMBL12830656 | 0.84 | PTGS2 (0.83) | PTGS2PTGS1CYP19A1NQO2TLR9 | |
| SCHEMBL900893 | 0.83 | ALDH1A1 (0.75) | PTGS2PTGS1CYP19A1ESR1ALDH1A1 | |
| SCHEMBL900894 | 0.83 | ALDH1A1 (0.75) | PTGS2PTGS1CYP19A1ESR1ALDH1A1 | |
| SCHEMBL1005735 | 0.81 | PTGS2 (0.78) | PTGS2PTGS1CYP19A1TLR9NFE2L2 |
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-2010046926-A2 | NOVEL STILBENE ANALOGS | APTUIT LAURUS PVT LTD (IN) | 2010-04-29 | — | — | WO | disclosed |