Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 5/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.39 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.39 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.39 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.39 |
| ▸ | F10 | P00742 | 1/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4481434 | 1.00 | L3MBTL1 (0.41) | L3MBTL1CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL4481436 | 1.00 | L3MBTL1 (0.41) | L3MBTL1CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL4246218 | 0.88 | SIGMAR1 (0.39) | MEN1KMT2AKDM4ESIGMAR1NPSR1 | |
| Hydrochloric Acid SCHEMBL4476757 | 0.87 | SIGMAR1 (0.39) | MEN1KMT2AKDM4ESIGMAR1NPSR1 | |
| SCHEMBL3137972 | 0.73 | L3MBTL1 (0.43) | L3MBTL1CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL3141592 | 0.72 | KDM4E (0.44) | L3MBTL1CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL3124156 | 0.70 | ALDH1A1 (0.42) | L3MBTL1CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL13637321 | 0.69 | ALDH1A1 (0.43) | KMT2AKDM4ESIGMAR1POLBALDH1A1 | |
| SCHEMBL13627302 | 0.69 | ALDH1A1 (0.43) | KMT2AKDM4ESIGMAR1POLBALDH1A1 | |
| SCHEMBL4492914 | 0.69 | ALDH1A1 (0.43) | KMT2AKDM4ESIGMAR1POLBALDH1A1 |
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-7618980-B2 | Pyrrolo(oxo)quinolines as 5HT ligands | BRISTOL-MYERS SQUIBB COMPANY (US) | 2009-11-17 | — | — | US | disclosed |