Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.45 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.45 |
| ▸ | AKR1C3 | P42330 | 4/20 | 0.44 |
| ▸ | AKR1C2 | P52895 | 4/20 | 0.44 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.44 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.44 |
| ▸ | AKR1C4 | P17516 | 2/20 | 0.44 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ACACB | O00763 | 1/20 | 0.42 |
| ▸ | FBP1 | P09467 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL6564098 | 0.91 | AKR1C3 (0.47) | KDM4EAKR1C3AKR1C2AKR1B10AKR1B1 | |
| SCHEMBL8633063 | 0.89 | SIRT6 (0.47) | KDM4EAKR1C3AKR1C2AKR1B10AKR1B1 | |
| SCHEMBL8629336 | 0.84 | HPD (0.52) | POLBAKR1C3AKR1C2AKR1B1AKR1C4 | |
| SCHEMBL6567226 | 0.84 | KDM4E (0.62) | PIN1KDM4EPOLBMTNR1BMTNR1A | |
| SCHEMBL6565205 | 0.78 | MTNR1B (0.45) | PIN1KDM4EPOLBMTNR1BMTNR1A | |
| SCHEMBL22065496 | 0.78 | ALDH1A1 (0.49) | KDM4EAKR1C3AKR1C2AKR1B10AKR1B1 | |
| SCHEMBL8628865 | 0.77 | HPD (0.47) | MAPTSMN1; SMN2TDP1MAPK1 | |
| SCHEMBL12326834 | 0.76 | ALDH1A1 (0.53) | KDM4EAKR1C3AKR1C2AKR1B10AKR1B1 | |
| SCHEMBL8630905 | 0.76 | MAPT (0.50) | KDM4EPOLBAKR1C3AKR1C2AKR1C1 | |
| SCHEMBL6567485 | 0.75 | PIN1 (0.52) | PIN1POLBMTNR1BMTNR1AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-5726305-A | Substituted quinoline-2-carboxamides, their preparation and their use as pharmaceuticals, and intermediates | HOECHST AKTIENGESELLSCHAFT (DE) | 1998-03-10 | — | — | US | disclosed |
| US-5719164-A | Substituted quinoline-2-carboxamides, their preparation and their use as pharmaceuticals, and intermediates | HOECHST AKTIENGESELLSCHAFT (DE) | 1998-02-17 | — | — | US | disclosed |