Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.52 |
| ▸ | PGR | P06401 | 2/20 | 0.52 |
| ▸ | HTR1A | P08908 | 1/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.52 |
| ▸ | AR | P10275 | 1/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.52 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.45 |
| ▸ | SIRT2 | Q8IXJ6 | 6/20 | 0.43 |
| ▸ | ANPEP | P15144 | 2/20 | 0.42 |
| ▸ | SIRT1 | Q96EB6 | 2/20 | 0.40 |
| ▸ | TPSAB1 | Q15661 | 2/20 | 0.39 |
| ▸ | CTSB | P07858 | 1/20 | 0.39 |
| ▸ | MAG | P20916 | 1/20 | 0.38 |
| ▸ | CTSL | P07711 | 1/20 | 0.38 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.38 |
| ▸ | KLK7 | P49862 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10832327 | 0.88 | NOD2 (0.57) | ESR1PGRHTR1AADORA3AR | |
| SCHEMBL10832236 | 0.83 | NOD2 (0.50) | ESR1PGRHTR1AADORA3AR | |
| SCHEMBL11115958 | 0.82 | NOD2 (0.61) | ESR1PGRHTR1AADORA3AR | |
| SCHEMBL31238292 | 0.82 | CHRM1 (0.42) | ESR1PGRHTR1AADORA3AR | |
| SCHEMBL11113553 | 0.81 | NOD2 (0.49) | ESR1PGRHTR1AADORA3AR | |
| SCHEMBL29387077 | 0.80 | NOD2 (0.63) | ESR1PGRHTR1AADORA3AR | |
| SCHEMBL10832555 | 0.80 | NOD2 (0.42) | ESR1PGRHTR1AADORA3AR | |
| Water SCHEMBL10831450 | 0.78 | NOD2 (0.72) | ESR1PGRHTR1AADORA3AR | |
| SCHEMBL10832298 | 0.78 | ESR1 (0.45) | ESR1PGRHTR1AADORA3AR | |
| SCHEMBL10831718 | 0.77 | NOD2 (0.48) | ESR1PGRHTR1AADORA3AR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |