Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.53 |
| ▸ | NLRP3 | Q96P20 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.47 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.47 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.47 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | MIF | P14174 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MGAM | O43451 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | SI | P14410 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1166949 | 0.87 | KMT2A (0.54) | SMN1; SMN2NLRP3CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL1821800 | 0.84 | ALDH1A1 (0.49) | SMN1; SMN2MIFALDH1A1MEN1KMT2A | |
| SCHEMBL12692656 | 0.84 | NLRP3 (0.44) | SMN1; SMN2NLRP3NPC1RAB9ACYP1A2 | |
| SCHEMBL10147411 | 0.84 | SMN1; SMN2 (0.50) | SMN1; SMN2NLRP3NPC1RAB9ATAS1R3 | |
| SCHEMBL17844025 | 0.83 | HTT (0.60) | SMN1; SMN2NPC1RAB9ACYP1A2CYP2C9 | |
| SCHEMBL11499565 | 0.83 | SMN1; SMN2 (0.45) | SMN1; SMN2NLRP3NPC1TAS1R3TAS1R1 | |
| SCHEMBL17709618 | 0.83 | MEN1 (0.56) | SMN1; SMN2NLRP3NPC1RAB9ACYP1A2 | |
| SCHEMBL31493228 | 0.83 | HTT (0.60) | SMN1; SMN2NPC1RAB9ACYP1A2CYP2C9 | |
| SCHEMBL28675648 | 0.82 | MEN1 (0.56) | SMN1; SMN2NLRP3NPC1RAB9ACYP1A2 | |
| SCHEMBL13008025 | 0.81 | NLRP3 (0.44) | SMN1; SMN2NLRP3NPC1RAB9ACYP1A2 |
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-4032634-A | O,O-DIALKYL-O-(1-PHENYL-2-CARBALKOXYVINYL)-THIONOPHOSPHORIC ACID ESTERS AND INSECTICIDAL AND ACARICIDAL COMPOSITIONS AND METHOD OF USE THEREOF | BAYER AKTIENGESELLSCHAFT (DT) | 1977-06-28 | — | — | US | disclosed |