Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 1/20 | 0.50 |
| ▸ | PARP1 | P09874 | 3/20 | 0.47 |
| ▸ | GSK3B | P49841 | 1/20 | 0.46 |
| ▸ | DHODH | Q02127 | 4/20 | 0.45 |
| ▸ | TDO2 | P48775 | 1/20 | 0.43 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.43 |
| ▸ | SSTR5 | P35346 | 3/20 | 0.43 |
| ▸ | MGAM | O43451 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | SI | P14410 | 3/20 | 0.43 |
| ▸ | MGAM2 | Q2M2H8 | 3/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8816971 | 0.88 | PARP1 (0.61) | PARP1DHODHCHEK2GAA | |
| SCHEMBL4457030 | 0.85 | DHODH (0.53) | PARP1DHODHMGAMGAASI | |
| SCHEMBL230979 | 0.82 | DHODH (0.53) | PARP1DHODHMGAMGAASI | |
| SCHEMBL31027957 | 0.82 | DHODH (0.59) | PARP1DHODHMGAMGAASI | |
| SCHEMBL14587793 | 0.82 | PSMB8 (0.56) | PIN1PARP1GSK3BSSTR5MGAM | |
| SCHEMBL7146754 | 0.81 | DHODH (0.62) | PARP1DHODHCHEK2MGAMGAA | |
| SCHEMBL1170898 | 0.81 | DHODH (0.54) | PARP1DHODHMGAMGAASI | |
| SCHEMBL3338846 | 0.80 | KDM4E (0.61) | PIN1CHEK2GAA | |
| SCHEMBL9346643 | 0.79 | GAA (0.54) | PARP1DHODHMGAMGAASI | |
| SCHEMBL8891044 | 0.79 | MGAM (0.68) | PARP1DHODHMGAMGAASI |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997033873-A1 | METHODS OF TREATING OR PREVENTING INTERSTITIAL CYSTITIS | ELI LILLY AND COMPANY (US) | 1997-09-18 | — | — | WO | disclosed |
| WO-1997031635-A1 | METHODS OF TREATING OR PREVENTING SLEEP APNEA | ELI LILLY AND COMPANY (US) | 1997-09-04 | — | — | WO | disclosed |