Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | MPO | P05164 | 1/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.38 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.38 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.38 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9480367 | 0.84 | PIN1 (0.43) | PIN1SMN1; SMN2RAB9ACDK1CCNB1 | |
| SCHEMBL445016 | 0.72 | NPC1 (0.42) | SMN1; SMN2NPC1RAB9ALTA4HFFAR1 | |
| SCHEMBL9481771 | 0.70 | PIN1 (0.44) | PIN1SMN1; SMN2NPC1RAB9AMPO | |
| SCHEMBL9480329 | 0.68 | NPC1 (0.38) | SMN1; SMN2NPC1RAB9ALTA4HFFAR1 | |
| SCHEMBL9705397 | 0.67 | L3MBTL1 (0.51) | SMN1; SMN2NPC1RAB9AMAPK14CYP11B1 | |
| SCHEMBL5586521 | 0.67 | HPGD (0.41) | NPC1RAB9AMAPK14CYP11B1CYP11B2 | |
| SCHEMBL7757368 | 0.66 | — | — | |
| SCHEMBL22131697 | 0.66 | ACACB (0.47) | PIN1SMN1; SMN2NPC1RAB9AMPO | |
| SCHEMBL9370072 | 0.65 | PIN1 (0.51) | PIN1SMN1; SMN2NPC1RAB9AMPO | |
| SCHEMBL31447193 | 0.65 | NPC1 (0.53) | PIN1SMN1; SMN2NPC1RAB9ALTA4H |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0247381-B1 | 5-FLUROROURACIL DERIVATIVES | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1993-08-04 | — | — | EP | disclosed |
| US-5047521-A | Anticarcinogenic agents | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1991-09-10 | — | — | US | disclosed |
| EP-0247381-A2 | 5-flurorouracil derivatives | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1987-12-02 | — | — | EP | disclosed |