Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 2/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.42 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | PRCP | P42785 | 1/20 | 0.42 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.42 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3455254 | 0.80 | CYP3A4 (0.42) | SIGMAR1CYP3A4MEN1CYP2D6ALOX15 | |
| SCHEMBL21845155 | 0.79 | KDM1A (0.46) | KDM1AMAOBSIGMAR1CYP3A4MEN1 | |
| SCHEMBL11295093 | 0.79 | KDM1A (0.46) | KDM1AMAOBSIGMAR1CYP3A4MEN1 | |
| Hydrochloric Acid SCHEMBL11305790 | 0.78 | KDM1A (0.44) | KDM1AMAOBSIGMAR1CYP3A4MEN1 | |
| Hydrochloric Acid SCHEMBL26650153 | 0.78 | KDM1A (0.44) | KDM1AMAOBSIGMAR1CYP3A4MEN1 | |
| Hydrochloric Acid SCHEMBL30748045 | 0.78 | KDM1A (0.44) | KDM1AMAOBSIGMAR1CYP3A4MEN1 | |
| Hydrochloric Acid SCHEMBL26650350 | 0.78 | KDM1A (0.44) | KDM1AMAOBSIGMAR1CYP3A4MEN1 | |
| SCHEMBL29067174 | 0.74 | CYP3A4 (0.38) | SIGMAR1CYP3A4MEN1CYP2D6ALOX15 | |
| SCHEMBL9053824 | 0.73 | KDM1A (0.41) | KDM1ASIGMAR1CYP3A4MEN1CYP2D6 | |
| SCHEMBL8339885 | 0.71 | KDM1A (0.46) | KDM1AMAOBSIGMAR1CYP3A4MEN1 |
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-5498755-A | IMINE COMPOUNDS FOR SKIN DISORDERS AND ANTIINFLAMMATORY AGENTS | ALLERGAN, INC. | 1996-03-12 | — | — | US | disclosed |
| WO-1996006070-A1 | DISUBSTITUTED ARYL AND HETEROARYL IMINES HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY | ALLERGAN (US) | 1996-02-29 | — | — | WO | disclosed |