Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 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 | |
|---|---|---|---|---|
| SCHEMBL11208198 | 0.94 | ALDH1A1 (0.47) | ALDH1A1HPGDMTNR1AMTNR1BFFAR1 | |
| SCHEMBL11208151 | 0.81 | OPRM1 (0.39) | ALDH1A1HPGDMTNR1AMTNR1BFFAR1 | |
| SCHEMBL11265491 | 0.79 | FFAR1 (0.38) | ALDH1A1HPGDMTNR1AMTNR1BFFAR1 | |
| SCHEMBL10523948 | 0.78 | HSD17B10 (0.48) | ALDH1A1HPGDHSD17B10NAPRTSMN1; SMN2 | |
| SCHEMBL15116699 | 0.75 | ALDH1A1 (0.42) | ALDH1A1HPGDMTNR1AMTNR1BFFAR1 | |
| SCHEMBL6688633 | 0.74 | MAPT (0.43) | ALDH1A1HPGDFFAR1HSD17B10CYP1A2 | |
| SCHEMBL3150010 | 0.74 | SLC22A12 (0.50) | ALDH1A1HPGDFFAR1SLC22A12 | |
| SCHEMBL11201978 | 0.73 | LMNA (0.43) | ALDH1A1HPGDMTNR1AMTNR1BFFAR1 | |
| SCHEMBL11211696 | 0.73 | OPRM1 (0.42) | ALDH1A1HPGDMTNR1AMTNR1BFFAR1 | |
| SCHEMBL9463528 | 0.73 | ALDH1A1 (0.38) | ALDH1A1HPGDMTNR1AMTNR1BFFAR1 |
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 |