Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.60 |
| ▸ | ESR1 | P03372 | 2/20 | 0.45 |
| ▸ | PGR | P06401 | 2/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.45 |
| ▸ | AR | P10275 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | HK1 | P19367 | 2/20 | 0.44 |
| ▸ | HK2 | P52789 | 2/20 | 0.44 |
| ▸ | LGALS3 | P17931 | 2/20 | 0.39 |
| ▸ | LGALS9 | O00182 | 1/20 | 0.39 |
| ▸ | LGALS1 | P09382 | 1/20 | 0.39 |
| ▸ | LGALS7; LGALS7B | P47929 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 4/20 | 0.36 |
| ▸ | CA2 | P00918 | 4/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10831526 | 0.92 | NOD2 (0.52) | NOD2ESR1PGRHTR1AADORA3 | |
| SCHEMBL10832201 | 0.88 | NOD2 (0.78) | NOD2ESR1PGRHTR1AADORA3 | |
| Almurtide SCHEMBL94717 | 0.88 | NOD2 (0.77) | NOD2ESR1PGRHTR1AADORA3 | |
| SCHEMBL11151035 | 0.84 | NOD2 (0.51) | NOD2ESR1PGRHTR1AADORA3 | |
| SCHEMBL10832327 | 0.82 | NOD2 (0.57) | NOD2ESR1PGRHTR1AADORA3 | |
| SCHEMBL10832236 | 0.82 | NOD2 (0.50) | NOD2ESR1PGRHTR1AADORA3 | |
| SCHEMBL10831522 | 0.81 | NOD2 (0.56) | NOD2ESR1PGRHTR1AADORA3 | |
| SCHEMBL17299286 | 0.78 | NOD2 (0.85) | NOD2ESR1PGRHTR1AADORA3 | |
| SCHEMBL19486612 | 0.78 | NOD2 (0.85) | NOD2ESR1PGRHTR1AADORA3 | |
| SCHEMBL31268508 | 0.78 | NOD2 (0.76) | NOD2ESR1PGRHTR1AADORA3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4574058-A | Antigen derivatives and processes for their preparation | CIBA-GEIGY CORPORATION (US) | 1986-03-04 | — | — | US | disclosed |
| US-4446128-A | Antigen derivatives and processes for their preparation | CIBA-GEIGY CORPORATION (US) | 1984-05-01 | — | — | US | disclosed |
| US-4397844-A | Antigen derivatives and processes for their preparation | CIBA-GEIGY CORPORATION (US) | 1983-08-09 | — | — | US | disclosed |
| EP-0003833-B1 | ANTIGEN DERIVATIVES, PROCESS FOR THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | CIBA-GEIGY AG (CH) | 1983-07-20 | — | — | EP | disclosed |