Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I3 | Q14994 | 1/20 | 0.50 |
| ▸ | PTGES | O14684 | 1/20 | 0.48 |
| ▸ | MGAM | O43451 | 5/20 | 0.48 |
| ▸ | GAA | P10253 | 5/20 | 0.48 |
| ▸ | SI | P14410 | 5/20 | 0.48 |
| ▸ | MGAM2 | Q2M2H8 | 5/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8818857 | 0.88 | PTGES (0.44) | NR1I3PTGESMGAMGAASI | |
| SCHEMBL8818761 | 0.85 | NR1I3 (0.50) | NR1I3PTGESMGAMGAASI | |
| SCHEMBL8817558 | 0.85 | MGAM (0.51) | NR1I3PTGESMGAMGAASI | |
| SCHEMBL29056652 | 0.84 | PTGES (0.56) | NR1I3PTGESMGAMGAASI | |
| SCHEMBL8077963 | 0.82 | MAP4K4 (0.49) | NR1I3PTGESMGAMGAASI | |
| SCHEMBL8818534 | 0.81 | PTGES (0.38) | NR1I3PTGESMGAMGAASI | |
| SCHEMBL8077969 | 0.81 | CHEK2 (0.45) | NR1I3PTGESMGAMGAASI | |
| SCHEMBL8816713 | 0.81 | MGAM (0.51) | NR1I3PTGESMGAMGAASI | |
| SCHEMBL8818781 | 0.80 | MGAM (0.54) | NR1I3PTGESMGAMGAASI | |
| SCHEMBL8816632 | 0.80 | MGAM (0.56) | NR1I3PTGESMGAMGAASI |
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 |