Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 4/20 | 0.52 |
| ▸ | NPC1 | O15118 | 7/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.51 |
| ▸ | RAB9A | P51151 | 4/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.51 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.51 |
| ▸ | RELA | Q04206 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL9840452 | 1.00 | RARB (0.52) | RARBNPC1SMN1; SMN2RAB9AKDM4E | |
| SCHEMBL9839315 | 1.00 | RARB (0.52) | RARBNPC1SMN1; SMN2RAB9AKDM4E | |
| SCHEMBL9840250 | 1.00 | RARB (0.52) | RARBNPC1SMN1; SMN2RAB9AKDM4E | |
| SCHEMBL9840882 | 0.99 | NPC1 (0.52) | RARBNPC1SMN1; SMN2RAB9AKDM4E | |
| SCHEMBL9839425 | 0.96 | NPC1 (0.55) | RARBNPC1SMN1; SMN2RAB9AKDM4E | |
| SCHEMBL9840389 | 0.94 | NPC1 (0.52) | RARBNPC1SMN1; SMN2RAB9AKDM4E | |
| SCHEMBL10513208 | 0.92 | RARB (0.56) | RARBNPC1SMN1; SMN2RAB9AKDM4E | |
| SCHEMBL10514034 | 0.92 | RARB (0.56) | RARBNPC1SMN1; SMN2RAB9AKDM4E | |
| SCHEMBL10512258 | 0.92 | RARB (0.56) | RARBNPC1SMN1; SMN2RAB9AKDM4E | |
| SCHEMBL10513073 | 0.92 | RARB (0.56) | RARBNPC1SMN1; SMN2RAB9AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0220297-B1 | NITROGEN-CONTAINING HETEROCYCLES | MERCK PATENT GmbH (DE) | 1991-12-11 | — | — | EP | disclosed |