Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | IGF1R | P08069 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | CTSK | P43235 | 2/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL6693217 | 0.91 | CTSK (0.34) | SMN1; SMN2CYP2C19L3MBTL1LMNAMAPT | |
| SCHEMBL793641 | 0.87 | ALDH1A1 (0.40) | SMN1; SMN2L3MBTL1MAPK1ALDH1A1NPSR1 | |
| SCHEMBL20241539 | 0.84 | CA12 (0.35) | SMN1; SMN2CYP2C19L3MBTL1ALDH1A1LMNA | |
| SCHEMBL5082914 | 0.84 | GRIK1 (0.35) | SMN1; SMN2CYP2C19L3MBTL1MAPTTSHR | |
| SCHEMBL31612 | 0.84 | GRIK1 (0.35) | SMN1; SMN2CYP2C19L3MBTL1MAPTTSHR | |
| Butane SCHEMBL18797012 | 0.83 | TSHR (0.39) | SMN1; SMN2L3MBTL1MAPK1ALDH1A1NPSR1 | |
| SCHEMBL27664481 | 0.83 | SMN1; SMN2 (0.31) | SMN1; SMN2CYP2C19TSHRCTSKCYP3A4 | |
| SCHEMBL7601657 | 0.82 | SMN1; SMN2 (0.32) | SMN1; SMN2CYP2C19MAPTTSHRCTSK | |
| SCHEMBL8183510 | 0.82 | SMN1; SMN2 (0.32) | SMN1; SMN2CYP2C19MAPTTSHRCTSK | |
| SCHEMBL27863535 | 0.80 | TSHR (0.44) | SMN1; SMN2L3MBTL1MAPK1ALDH1A1NPSR1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5166377-A | Thromboxane A2 antagonist as coagulants or vasoconstrictors | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-11-24 | — | — | US | disclosed |
| US-4745198-A | CARDIOVASCULAR DISORDERS, BRONCHODILATOR AGENTS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1988-05-17 | — | — | US | disclosed |
| EP-0094239-B1 | 1,3-DIOXAN-5-YLALKENOIC ACIDS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1987-07-15 | — | — | EP | disclosed |
| US-4567197-A | THORMBOXANE A2 ANTAGONISTS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1986-01-28 | — | — | US | disclosed |
| EP-0046713-B1 | FLUORINATED PENTENE DIAMINE DERIVATIVES | MERRELL TORAUDE ET COMPAGNIE (FR) | 1985-12-27 | — | — | EP | disclosed |
| US-4439619-A | Fluorinated pentene diamine derivatives | MERRELL TORAUDE ET COMPAGNIE (FR) | 1984-03-27 | — | — | US | disclosed |
| EP-0094239-A2 | 1,3-Dioxan-5-ylalkenoic acids | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1983-11-16 | — | — | EP | disclosed |
| EP-0046713-A1 | Fluorinated pentene diamine derivatives | MERRELL TORAUDE ET COMPAGNIE (FR) | 1982-03-03 | — | — | EP | disclosed |