Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | RAB9A | P51151 | 5/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | STAT1 | P42224 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.40 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3818532 | 0.83 | ALDH1A1 (0.55) | TSHRALDH1A1TDP1L3MBTL1MAPK1 | |
| SCHEMBL7723904 | 0.82 | ALDH1A1 (0.54) | TSHRALDH1A1TDP1L3MBTL1MAPK1 | |
| SCHEMBL14989159 | 0.80 | GABRP (0.43) | MAPK1RAB9ANPSR1NPC1 | |
| SCHEMBL7736627 | 0.79 | ALDH1A1 (0.53) | TSHRALDH1A1TDP1L3MBTL1MAPK1 | |
| SCHEMBL316148 | 0.79 | TSHR (0.51) | TSHRALDH1A1TDP1L3MBTL1MAPK1 | |
| SCHEMBL316706 | 0.79 | TSHR (0.51) | TSHRALDH1A1TDP1L3MBTL1MAPK1 | |
| SCHEMBL7734039 | 0.78 | L3MBTL1 (0.50) | TSHRALDH1A1TDP1L3MBTL1MAPK1 | |
| SCHEMBL4893030 | 0.78 | ALDH1A1 (0.55) | TSHRALDH1A1TDP1L3MBTL1MAPK1 | |
| SCHEMBL3203139 | 0.78 | TDP1 (0.61) | TSHRALDH1A1TDP1L3MBTL1MAPK1 | |
| SCHEMBL29880892 | 0.77 | ALDH1A1 (0.64) | TSHRALDH1A1TDP1L3MBTL1MAPK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20080306190-A1 | Composition of matter based on alkyl benzyl esters | LANXESS DEUTSCHLAND GMBH (DE) | 2008-12-11 | — | — | US | claimed |
| US-20080004387-A1 | Alkyl benzyl esters of polycarboxylic acids | LANXESS DEUTSCHLAND GMBH (DE) | 2008-01-03 | — | — | US | claimed |
| US-20080004387-A1 | Alkyl benzyl esters of polycarboxylic acids | LANXESS DEUTSCHLAND GMBH (DE) | 2008-01-03 | — | — | US | disclosed |