Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.52 |
| ▸ | MAOB | P27338 | 3/20 | 0.52 |
| ▸ | MAOA | P21397 | 2/20 | 0.52 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | SLC26A3 | P40879 | 4/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8438210 | 0.82 | TSHR (0.48) | MAOBALDH1A1HTTKDM4EHPGD | |
| SCHEMBL8439801 | 0.76 | KDM4E (0.47) | ALDH1A1HTTKDM4EHPGDSMN1; SMN2 | |
| SCHEMBL24045268 | 0.73 | SLC26A3 (0.79) | SLC26A3 | |
| SCHEMBL8442557 | 0.73 | TAS1R3 (0.41) | MAOBMAOAALDH1A1HTTKDM4E | |
| SCHEMBL9209466 | 0.72 | MAOB (0.60) | MAOBALDH1A1HTTKDM4EHPGD | |
| SCHEMBL1650152 | 0.71 | LRRK2 (0.77) | LRRK2ALDH1A1HTT | |
| SCHEMBL8439784 | 0.70 | ESR2 (0.52) | MAOBALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL2761684 | 0.70 | LOXL2 (0.47) | MAOBALDH1A1KDM4EHPGD | |
| SCHEMBL2762090 | 0.70 | EGLN1 (0.47) | MAOB | |
| SCHEMBL8441390 | 0.69 | KDM4E (0.63) | MAOBALDH1A1HTTKDM4EHPGD |
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-5985912-A | COUMARONE COMPOUNDS AS BACTERICIDES | PFIZER INC. (US) | 1999-11-16 | — | — | US | disclosed |
| US-5624951-A | 4-hydroxy coumarin derivatives with antibacterial activity | PFIZER INC. (US) | 1997-04-29 | — | — | US | disclosed |