Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
| ▸ | MMP2 | P08253 | 6/20 | 0.44 |
| ▸ | MMP1 | P03956 | 5/20 | 0.44 |
| ▸ | MMP3 | P08254 | 5/20 | 0.44 |
| ▸ | MMP7 | P09237 | 5/20 | 0.44 |
| ▸ | MMP9 | P14780 | 5/20 | 0.44 |
| ▸ | MMP13 | P45452 | 5/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MMP14 | P50281 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4484070 | 0.94 | CYP1A2 (0.52) | PTGS2CYP1A2ALOX5SMN1; SMN2CYP2D6 | |
| SCHEMBL29318756 | 0.85 | CYP1A2 (0.48) | PTGS2CYP1A2ALOX5SMN1; SMN2CYP2D6 | |
| SCHEMBL421564 | 0.78 | PTGS2 (0.61) | PTGS2CYP1A2ALOX5SMN1; SMN2TSHR | |
| SCHEMBL3860971 | 0.78 | PTGS2 (0.61) | PTGS2CYP1A2ALOX5SMN1; SMN2TSHR | |
| SCHEMBL12280124 | 0.78 | CYP1A2 (0.55) | PTGS2CYP1A2ALOX5SMN1; SMN2CYP2D6 | |
| SCHEMBL5149430 | 0.78 | PTGS2 (0.61) | PTGS2CYP1A2ALOX5SMN1; SMN2TSHR | |
| SCHEMBL4493827 | 0.77 | EPHX1 (0.58) | CYP1A2ALOX5SMN1; SMN2CYP2D6TSHR | |
| SCHEMBL2291864 | 0.77 | CYP1A2 (0.48) | PTGS2CYP1A2ALOX5SMN1; SMN2CYP2D6 | |
| SCHEMBL3875094 | 0.77 | EPHX1 (0.58) | CYP1A2ALOX5SMN1; SMN2CYP2D6TSHR | |
| SCHEMBL9680223 | 0.76 | CYP1A2 (0.44) | CYP1A2ALOX5MMP2MMP1MMP3 |
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-5136013-A | Polyesters | BAYER AKTIENGESELLSCHAFT (DE) | 1992-08-04 | — | — | US | disclosed |
| US-5068300-A | BIFUNCTIONAL STILBENE COMPOUNDS CONTAINING AT LEAST ONE Z-CONFIGURATED STILBENE GROUP, PROCESS FOR THEIR PREPARATION AND THEIR USE FOR THE PREPARATION OF POLYMERS | BAYER AKTIENGESELLSCHAFT (DE) | 1991-11-26 | — | — | US | disclosed |