Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | GSR | P00390 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | NPY1R | P25929 | 1/20 | 0.33 |
| ▸ | NPY2R | P49146 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Allylbenzene SCHEMBL7049968 | 0.93 | ALDH1A1 (0.67) | ALDH1A1TSHRGRIN1GRIN2BLMNA | |
| Styrene SCHEMBL7556859 | 0.86 | ALDH1A1 (0.78) | ALDH1A1TSHRGRIN1GRIN2BLMNA | |
| Styrene SCHEMBL28849678 | 0.84 | ALDH1A1 (0.75) | ALDH1A1TSHRGRIN1GRIN2BLMNA | |
| Allylbenzene SCHEMBL757639 | 0.84 | ALDH1A1 (0.64) | ALDH1A1TSHRMAOBSMN1; SMN2HPGD | |
| Allylbenzene SCHEMBL9774331 | 0.81 | ALDH1A1 (0.50) | ALDH1A1TSHRGRIN1GRIN2BLMNA | |
| Allylbenzene SCHEMBL28845696 | 0.81 | ALDH1A1 (0.45) | ALDH1A1TSHRMAOBSMN1; SMN2HPGD | |
| Allylbenzene SCHEMBL7056463 | 0.80 | MAOB (0.48) | ALDH1A1TSHRMAOBSMN1; SMN2HPGD | |
| SCHEMBL29389188 | 0.76 | — | — | |
| SCHEMBL678283 | 0.76 | ALDH1A1 (1.00) | ALDH1A1TSHRGRIN1GRIN2BLMNA | |
| SCHEMBL15848 | 0.76 | — | — |
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-5571847-A | COATING CARBON BLACK WITH POLYMERIZABLE MONOMERS AND BLOWING AGENTS THEN POLYMERIZATION | THE DOW CHEMICAL COMPANY (US) | 1996-11-05 | — | — | US | disclosed |