Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.30 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4621531 | 0.75 | — | — | |
| SCHEMBL28872629 | 0.75 | TDP1 (0.35) | TSHRTDP1 | |
| SCHEMBL10457240 | 0.73 | TSHR (0.33) | CES2CES1TSHRTDP1FFAR3 | |
| SCHEMBL3927240 | 0.73 | CES2 (0.33) | CES2CES1TSHRFFAR3HDAC3 | |
| SCHEMBL10457095 | 0.69 | ALDH1A1 (0.32) | CES2CES1TSHRTDP1 | |
| SCHEMBL11779221 | 0.69 | CES1 (0.43) | CES2CES1TSHRFFAR3HDAC3 | |
| SCHEMBL15910598 | 0.67 | — | — | |
| SCHEMBL5968061 | 0.67 | — | — | |
| SCHEMBL28497600 | 0.67 | — | — | |
| SCHEMBL10456161 | 0.65 | CES1 (0.36) | CES2CES1 |
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-4980346-A | N-ALKYL(ENE)-N-(O,O-DISUBSTITUTED-THIOPHOSPHORYL)-N',N' -SUBSTITUTED GLYCINE AMIDE DERIVATIVES | ESZAKMAGYARORSUAGI VEGYIMUVEK (HU) | 1990-12-25 | — | — | US | disclosed |
| US-4870065-A | MITICIDES | ESZAKMAGYARORSZAGI VEGYIMUVEK (HU) | 1989-09-26 | — | — | US | disclosed |