Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 4/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.39 |
| ▸ | F13A1 | P00488 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.37 |
| ▸ | FABP4 | P15090 | 1/20 | 0.36 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 2/20 | 0.35 |
| ▸ | PPARD | Q03181 | 1/20 | 0.35 |
| ▸ | PPARA | Q07869 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Glycine SCHEMBL6884146 | 0.93 | PTGS1 (0.39) | PTGS1PTGS2LMNASLC22A6F13A1 | |
| Succinic Acid SCHEMBL7413466 | 0.70 | LMNA (0.56) | PTGS1PTGS2LMNASLC22A6F13A1 | |
| Benzoquinone SCHEMBL27348089 | 0.67 | FFAR3 (0.65) | SLC22A6TSHRFABP4FABP5PPARG | |
| Hexanoate SCHEMBL27701516 | 0.67 | AKR1B1 (0.70) | PTGS1LMNASLC22A6TSHRFABP4 | |
| SCHEMBL11721399 | 0.66 | — | — | |
| SCHEMBL27941676 | 0.64 | LMNA (0.40) | LMNASLC22A6TSHRNFKB1PMP22 | |
| SCHEMBL22798363 | 0.64 | PPARG (0.49) | PTGS1PTGS2LMNAF13A1TSHR | |
| SCHEMBL25205940 | 0.63 | LMNA (0.38) | LMNASLC22A6TSHRNFKB1PMP22 | |
| Glutarate SCHEMBL27824860 | 0.61 | SLC22A6 (0.85) | LMNASLC22A6TSHRNFKB1PMP22 | |
| Adipic Acid SCHEMBL27479224 | 0.61 | LMNA (0.85) | LMNASLC22A6TSHRNFKB1PMP22 |
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-2004087933-A2 | A NOVEL ENCODING METHOD FOR 'ONE-BEAD ONE-COMPOUND' COMBINATORIAL LIBRARIES | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2004-10-14 | — | — | WO | disclosed |