Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 8/20 | 0.44 |
| ▸ | RARA | P10276 | 1/20 | 0.44 |
| ▸ | RARG | P13631 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | CTRC | Q99895 | 1/20 | 0.39 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | EIF4A1 | P60842 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8774036 | 0.96 | RARB (0.49) | RARBRARARARGRAB9ASMN1; SMN2 | |
| SCHEMBL8774498 | 0.95 | HTR2A (0.40) | RARBRARARARGNPC1RAB9A | |
| SCHEMBL8774823 | 0.91 | HTR2A (0.46) | RARBRARARARGTP53ALDH1A1 | |
| SCHEMBL8774334 | 0.91 | NPC1 (0.40) | RARBRARARARGNPC1RAB9A | |
| SCHEMBL8774041 | 0.90 | HTR2A (0.49) | RARBRARARARGTP53ALDH1A1 | |
| SCHEMBL8774513 | 0.88 | TAAR1 (0.39) | RARBRARARARGNPC1RAB9A | |
| SCHEMBL8774925 | 0.88 | CYP2D6 (0.46) | RARBRARANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL8774829 | 0.86 | RAB9A (0.36) | NPC1RAB9ASMN1; SMN2TP53ALDH1A1 | |
| SCHEMBL8774330 | 0.86 | CYP3A4 (0.43) | RARBRARARARGRAB9ASMN1; SMN2 | |
| SCHEMBL8774685 | 0.84 | RARB (0.45) | RARBRARARARGNPC1RAB9A |
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-0519370-B1 | Heterocyclic derivatives | MERCK PATENT GMBH (DE) | 1997-11-05 | — | — | EP | disclosed |
| EP-0519370-A2 | Heterocyclic derivatives | MERCK PATENT GmbH (DE) | 1992-12-23 | — | — | EP | disclosed |