Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.33 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.33 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.33 |
| ▸ | GSK3A | P49840 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | MGLL | Q99685 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | DHFR | P00374 | 1/20 | 0.32 |
| ▸ | RARB | P10826 | 1/20 | 0.32 |
| ▸ | NAAA | Q02083 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10380851 | 1.00 | TDP1 (0.36) | TDP1L3MBTL1KCNH2KDM4EHPGD | |
| SCHEMBL28934057 | 0.77 | TYR (0.41) | TDP1L3MBTL1KCNH2KDM4EHPGD | |
| SCHEMBL3804484 | 0.76 | TDP1 (0.39) | TDP1L3MBTL1KCNH2KDM4EHPGD | |
| SCHEMBL28009761 | 0.76 | NOS2 (0.42) | TDP1L3MBTL1KCNH2KDM4EHPGD | |
| SCHEMBL250968 | 0.75 | TDP1 (0.41) | TDP1L3MBTL1KCNH2KDM4EHPGD | |
| SCHEMBL28182429 | 0.75 | NOS2 (0.41) | TDP1L3MBTL1KCNH2KDM4EHPGD | |
| SCHEMBL28182387 | 0.75 | NOS2 (0.41) | TDP1L3MBTL1KCNH2KDM4EHPGD | |
| SCHEMBL31282524 | 0.75 | NOS2 (0.41) | TDP1L3MBTL1KCNH2KDM4EHPGD | |
| SCHEMBL31283581 | 0.75 | NOS2 (0.41) | TDP1L3MBTL1KCNH2KDM4EHPGD | |
| SCHEMBL28323117 | 0.75 | NOS2 (0.41) | TDP1L3MBTL1KCNH2KDM4EHPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1990001478-A1 | SYNERGISTIC CORROSION INHIBITORS BASED ON SUBSTITUTED PYRIDINIUM COMPOUNDS | SRI INTERNATIONAL (US) | 1990-02-22 | — | — | WO | disclosed |