Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 2/20 | 0.46 |
| ▸ | MAOB | P27338 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Tetrahydrofuran SCHEMBL27959573 | 0.83 | FKBP1A (0.44) | SIGMAR1POLBFKBP1ALMNAALDH1A1 | |
| Phenyl Propionic Acid SCHEMBL29256162 | 0.82 | KEAP1 (0.70) | FKBP1ALMNAFFAR1ALDH1A1SLC6A3 | |
| Ethylbenzene SCHEMBL3255269 | 0.81 | TP53 (0.64) | SIGMAR1POLBFKBP1ALMNAALDH1A1 | |
| (Chloromethyl)Benzene SCHEMBL27762297 | 0.81 | FKBP1A (0.41) | SIGMAR1POLBFKBP1ALMNAALDH1A1 | |
| Benzyl Bromide SCHEMBL17239892 | 0.81 | ALDH1A1 (0.64) | SIGMAR1POLBFKBP1ALMNAALDH1A1 | |
| Benzylamine SCHEMBL27576789 | 0.81 | LOXL2 (0.64) | SIGMAR1POLBFKBP1ALMNAMAOB | |
| Benzyl Alcohol SCHEMBL969382 | 0.81 | TSHR (0.64) | SIGMAR1POLBFKBP1ALMNAALDH1A1 | |
| Cyclooctane SCHEMBL18187569 | 0.81 | SIGMAR1 (0.58) | SIGMAR1MAOAMAOBALDH1A1HPGD | |
| Fluoride SCHEMBL27972865 | 0.81 | ALDH1A1 (0.65) | SIGMAR1FFAR1MAOAMAOBALDH1A1 | |
| Tetrahydrofuran SCHEMBL28927730 | 0.80 | FKBP1A (0.57) | FKBP1AFFAR1ALDH1A1HPGDSLC6A3 |
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-5698524-A | PREPARING WATER SOLUBLE REACTION PRODUCT POLYMER OF LIGNIN AND LIGNOID THAT HAVE EACH BEEN EXTRACTED FROM WOOD OR WOOD-LIKE MATERIALS UNDER ACIDIC AND/OR ALKALINE CONDITIONS | MACH WALTER (DE) | 1997-12-16 | — | — | US | disclosed |
| US-5554596-A | POLYMER WITH LIGNIN UNITS AND LIGNOID UNITS | MACH WALTER (DE) | 1996-09-10 | — | — | US | disclosed |