Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.37 |
| ▸ | ABL1 | P00519 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19399205 | 0.76 | HCRTR2 (0.48) | ALDH1A1MAPTL3MBTL1HCRTR2NPC1 | |
| SCHEMBL4638064 | 0.73 | ENPP3 (0.55) | HSP90AA1HSP90AB1ALDH1A1CYP19A1IDO1 | |
| SCHEMBL30263376 | 0.73 | HSP90AA1 (0.50) | HSP90AA1HSP90AB1ALDH1A1CYP19A1IDO1 | |
| SCHEMBL24107475 | 0.73 | HSP90AA1 (0.50) | HSP90AA1HSP90AB1ALDH1A1CYP19A1IDO1 | |
| SCHEMBL30605718 | 0.69 | STAT3 (0.52) | ALDH1A1HTTCHRNB2CHRNA4SMN1; SMN2 | |
| SCHEMBL4639385 | 0.69 | HSP90AA1 (0.39) | HSP90AA1HSP90AB1CYP19A1IDO1SMN1; SMN2 | |
| SCHEMBL4638829 | 0.69 | NPC1 (0.40) | ALDH1A1HTTTSHRSMN1; SMN2LMNA | |
| SCHEMBL20501614 | 0.68 | IDO1 (0.41) | CYP19A1IDO1HCRTR2CLK4 | |
| Hydrochloric Acid SCHEMBL30605737 | 0.68 | STAT3 (0.51) | ALDH1A1HTTCHRNB2CHRNA4SMN1; SMN2 | |
| SCHEMBL21834023 | 0.66 | ALDH1A1 (0.44) | ALDH1A1TSHRLMNAMAPTHCRTR2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1501808-B1 | TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-07-02 | — | — | EP | disclosed |
| CN-1649849-A | Tachykinin receptor antagonists | LILLY CO ELI (US) | 2005-08-03 | — | — | CN | disclosed |