Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 3/20 | 0.45 |
| ▸ | GART | P22102 | 3/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 2/20 | 0.33 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8324327 | 0.85 | DHFR (0.47) | DHFRGARTNOS1 | |
| SCHEMBL7490675 | 0.83 | DHFR (0.56) | DHFRGARTNOS1 | |
| SCHEMBL8874134 | 0.83 | DHFR (0.56) | DHFRGARTNOS1 | |
| Hydrochloric Acid SCHEMBL7487428 | 0.83 | DHFR (0.55) | DHFRGARTNOS1 | |
| Hydrochloric Acid SCHEMBL8875657 | 0.83 | DHFR (0.55) | DHFRGARTNOS1 | |
| SCHEMBL9460931 | 0.83 | DHFR (0.47) | DHFRGARTMAOBNOS1NOS3 | |
| SCHEMBL9709383 | 0.80 | DHFR (0.43) | DHFRGARTNOS1KCNH2 | |
| SCHEMBL9460668 | 0.79 | DHFR (0.41) | DHFRGART | |
| SCHEMBL9460927 | 0.78 | DHFR (0.41) | DHFRGARTMAOAMAOBNOS1 | |
| SCHEMBL9460872 | 0.76 | MAOB (0.41) | DHFRMAOB |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5633373-A | Enantioselective synthesis of antifolates | ELI LILLY AND COMPANY (US) | 1997-05-27 | — | — | US | disclosed |
| EP-0407212-B1 | Enantioselective synthesis of antifolates | LILLY CO ELI (US) | 1996-05-22 | — | — | EP | disclosed |
| US-5516776-A | Enantioselective synthesis of antifolates | ELI LILLY AND COMPANY (US) | 1996-05-14 | — | — | US | disclosed |
| US-5159090-A | Enantioselective synthesis of antifolates | ELI LILLY AND COMPANY (US) | 1992-10-27 | — | — | US | disclosed |
| US-5008391-A | Enantioselective synthesis of antifolates | ELI LILLY AND COMPANY (US) | 1991-04-16 | — | — | US | disclosed |
| EP-0407212-A1 | Enantioselective synthesis of antifolates | ELI LILLY AND COMPANY (US) | 1991-01-09 | — | — | EP | disclosed |