Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.55 |
| ▸ | LCK | P06239 | 1/20 | 0.55 |
| ▸ | AKR1C3 | P42330 | 7/20 | 0.53 |
| ▸ | AKR1C2 | P52895 | 5/20 | 0.53 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.53 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | PPARG | P37231 | 2/20 | 0.47 |
| ▸ | PPARD | Q03181 | 2/20 | 0.47 |
| ▸ | PPARA | Q07869 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8366372 | 0.88 | ALDH1A1 (0.56) | KDM4EAKR1C3AKR1C2SMN1; SMN2ALDH1A1 | |
| SCHEMBL9766045 | 0.82 | MEN1 (0.51) | KDM4EHSD17B10SMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL2685182 | 0.81 | MTNR1A (0.63) | KDM4EAKR1C3AKR1C2AKR1C4PTGS1 | |
| SCHEMBL8457832 | 0.81 | KDM4E (0.48) | KDM4ELCKHSD17B10PPARGSMN1; SMN2 | |
| SCHEMBL8364439 | 0.81 | ALDH1A1 (0.49) | KDM4EAKR1C3AKR1C2AKR1C4PTGS1 | |
| SCHEMBL8367148 | 0.81 | AKR1C3 (0.49) | KDM4EAKR1C3AKR1C2HSD17B10ALDH1A1 | |
| SCHEMBL9157244 | 0.79 | KDM4E (0.56) | KDM4EHSD17B10ALDH1A1HPGDTSHR | |
| SCHEMBL9156302 | 0.78 | KDM4E (0.46) | KDM4EHSD17B10ALDH1A1HPGDLMNA | |
| SCHEMBL8366369 | 0.77 | ALDH1A1 (0.44) | KDM4EHSD17B10ALDH1A1HPGDMAPT | |
| SCHEMBL6208739 | 0.77 | MAPT (0.56) | KDM4EHSD17B10NPSR1SMN1; SMN2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0850235-B1 | QUINOLEIN-2(1H)-ONE DERIVATIVES AS SEROTONIN ANTAGONISTS | SANOFI SYNTHELABO (FR) | 1999-12-01 | — | — | EP | disclosed |
| US-5958924-A | HYPOTENSIVE AGENTS, CARDIOVASCULAR DISORDERS, ANTIISCHEMIC AGENTS, RESTENOSIS, ANTICOALUGANTS, RESPIRATORY SYSTEM DISORDERS | SYNTHELABO (FR) | 1999-09-28 | — | — | US | disclosed |