Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.53 |
| ▸ | CYP1A1 | P04798 | 4/20 | 0.53 |
| ▸ | CYP1B1 | Q16678 | 4/20 | 0.53 |
| ▸ | PDE5A | O76074 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | HPGD | P15428 | 4/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.52 |
| ▸ | TSHR | P16473 | 4/20 | 0.52 |
| ▸ | MAPT | P10636 | 4/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | CASP1 | P29466 | 3/20 | 0.52 |
| ▸ | CASP7 | P55210 | 3/20 | 0.52 |
| ▸ | GLA | P06280 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | HTR7 | P34969 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | BLM | P54132 | 2/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL4743709 | 0.91 | BAZ2B (0.56) | CYP1A2CYP1A1CYP1B1KDM4EALDH1A1 | |
| SCHEMBL8035810 | 0.84 | KDR (0.57) | CYP1A2CYP1A1CYP1B1KDM4EALDH1A1 | |
| SCHEMBL7851172 | 0.83 | MAPK10 (0.44) | CYP1A2CYP1A1CYP1B1PDE5AKDM4E | |
| SCHEMBL6950760 | 0.81 | KDM4E (0.54) | CYP1A2CYP1A1CYP1B1PDE5AKDM4E | |
| SCHEMBL8039621 | 0.80 | MTNR1A (0.40) | CYP1A2CYP1A1CYP1B1PDE5AKMT2A | |
| SCHEMBL8035843 | 0.80 | NOTUM (0.40) | CYP1A2CYP1A1CYP1B1PDE5AKDM4E | |
| SCHEMBL7347436 | 0.79 | MAPKAPK2 (0.51) | CYP1A2CYP1A1CYP1B1KDM4EALDH1A1 | |
| SCHEMBL8037930 | 0.79 | NOTUM (0.39) | CYP1A2CYP1A1CYP1B1PDE5AKDM4E | |
| SCHEMBL7509012 | 0.78 | MAPKAPK2 (0.50) | CYP1A2CYP1A1CYP1B1KDM4EALDH1A1 | |
| SCHEMBL7508089 | 0.78 | KDM4E (0.51) | CYP1A2CYP1A1CYP1B1KDM4EALDH1A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0781281-B1 | BETA-CARBOLINE DERIVATIVES AS MELATONIN AGONISTS, METHODS FOR THEIR PREPARATION AND THEIR USE AS DRUGS | MACEF (FR) | 2001-12-19 | — | — | EP | claimed |
| EP-0781281-B1 | BETA-CARBOLINE DERIVATIVES AS MELATONIN AGONISTS, METHODS FOR THEIR PREPARATION AND THEIR USE AS DRUGS | MACEF (FR) | 2001-12-19 | — | — | EP | disclosed |
| US-6048868-A | CIRCADIAN RHYTHM DISORDERS; SLEEP DISORDERS; ANTIDEPRESSANTS | CEMAF (FR) | 2000-04-11 | — | — | US | disclosed |
| EP-0781281-A1 | NOVEL MELATONIN AGONIST $g(b)-CARBOLINE DERIVATIVES AND ANALOGS WITH A NAPHTHALENIC STRUCTURE, METHOD FOR THEIR PREPARATION AND THEIR USE AS DRUGS | CEMAF (FR) | 1997-07-02 | — | — | EP | disclosed |
| WO-1996008490-A1 | NOVEL MELATONIN AGONIST β-CARBOLINE DERIVATIVES AND ANALOGS WITH A NAPHTHALENIC STRUCTURE, METHOD FOR THEIR PREPARATION AND THEIR USE AS DRUGS | CEMAF (FR) | 1996-03-21 | — | — | WO | disclosed |