Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.43 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.43 |
| ▸ | FNTA | P49354 | 1/20 | 0.38 |
| ▸ | FNTB | P49356 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.34 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.30 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.30 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18975252 | 0.89 | GPR84 (0.48) | GPR84FFAR1FFAR4FNTAFNTB | |
| SCHEMBL19817118 | 0.87 | GPR84 (0.44) | GPR84FFAR1FFAR4FNTAFNTB | |
| SCHEMBL13160784 | 0.84 | GPR84 (0.57) | GPR84FFAR1FFAR4FNTAFNTB | |
| SCHEMBL15621025 | 0.80 | — | — | |
| SCHEMBL25303773 | 0.80 | GPR84 (0.52) | GPR84FFAR1FFAR4FNTAFNTB | |
| SCHEMBL26136419 | 0.78 | HAO1 (0.50) | GPR84FFAR1FFAR4HAO1 | |
| SCHEMBL28460206 | 0.77 | HAO1 (0.44) | HAO1 | |
| SCHEMBL28257446 | 0.76 | ALDH1A1 (0.30) | — | |
| SCHEMBL7266153 | 0.75 | KDM4E (0.40) | FNTAFNTBKDM4EHAO1 | |
| SCHEMBL12855872 | 0.74 | GPR84 (0.46) | GPR84FFAR1FFAR4FNTAFNTB |
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-20170166679-A1 | POLYURETHANE MATERIALS FORMED FROM UNSATURATED PLANT OILS VIA AN ALKYNE ZIPPER REACTION | INTERNATIONAL BUSINESS MACHINES CORPORATION | 2017-06-15 | — | — | US | disclosed |