Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | HPGD | P15428 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | MGLL | Q99685 | 1/20 | 0.33 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | PLIN5 | Q00G26 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | ABHD5 | Q8WTS1 | 1/20 | 0.32 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11264686 | 0.79 | ALDH1A1 (0.42) | FFAR1CYP1A2ALDH1A1HPGDMAPT | |
| SCHEMBL11208198 | 0.76 | ALDH1A1 (0.47) | FFAR1ALDH1A1HPGDMAPTSMN1; SMN2 | |
| SCHEMBL6688633 | 0.74 | MAPT (0.43) | FFAR1CYP1A2ALDH1A1HPGDMAPT | |
| SCHEMBL3150010 | 0.70 | SLC22A12 (0.50) | FFAR1ALDH1A1HPGD | |
| SCHEMBL21253178 | 0.70 | CYP1A2 (0.46) | FFAR1CYP1A2ALDH1A1HPGDMAPT | |
| SCHEMBL15114537 | 0.70 | CES1 (0.41) | FFAR1CYP1A2ALDH1A1HPGDMAPT | |
| SCHEMBL11211696 | 0.69 | OPRM1 (0.42) | FFAR1ALDH1A1HPGDMAPTSMN1; SMN2 | |
| SCHEMBL11201978 | 0.69 | LMNA (0.43) | FFAR1ALDH1A1HPGDMAPTSMN1; SMN2 | |
| SCHEMBL10714432 | 0.68 | CYP1A2 (0.45) | FFAR1CYP1A2ALDH1A1HPGDMAPT | |
| SCHEMBL11208113 | 0.67 | KCNN4 (0.44) | ALDH1A1HPGDMAPTHSD17B10NPSR1 |
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-4342705-A | CONTAINING CARBONYL OR CYANO FUNCTIONAL GROUPS, USEFUL AS VULCANIZATION INHIBITORS | MONSANTO COMPANY (US) | 1982-08-03 | — | — | US | disclosed |
| US-4271050-A | Vulcanizable rubber compositions inhibited from premature vulcanization by methylene thioethers | MONSANTO COMPANY (US) | 1981-06-02 | — | — | US | disclosed |