Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 11/20 | 0.75 |
| ▸ | ESR1 | P03372 | 10/20 | 0.75 |
| ▸ | PKLR | P30613 | 1/20 | 0.66 |
| ▸ | GALNT2 | Q10471 | 1/20 | 0.66 |
| ▸ | GALNT1 | Q10472 | 1/20 | 0.66 |
| ▸ | GALNT3 | Q14435 | 1/20 | 0.66 |
| ▸ | GALNT10 | Q86SR1 | 1/20 | 0.66 |
| ▸ | GALNT13 | Q8IUC8 | 1/20 | 0.66 |
| ▸ | GALNT6 | Q8NCL4 | 1/20 | 0.66 |
| ▸ | GALNT14 | Q96FL9 | 1/20 | 0.66 |
| ▸ | ATP1A1 | P05023 | 3/20 | 0.60 |
| ▸ | ATP1B1 | P05026 | 3/20 | 0.60 |
| ▸ | ATP1A3 | P13637 | 3/20 | 0.60 |
| ▸ | ATP1B2 | P14415 | 3/20 | 0.60 |
| ▸ | ATP1A2 | P50993 | 3/20 | 0.60 |
| ▸ | ATP1B3 | P54709 | 3/20 | 0.60 |
| ▸ | FXYD2 | P54710 | 3/20 | 0.60 |
| ▸ | ATP1A4 | Q13733 | 3/20 | 0.60 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.60 |
| ▸ | MET | P08581 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL9748319 | 0.81 | ATP1A1 (0.61) | ESR2ESR1PKLRGALNT2GALNT1 | |
| SCHEMBL9748258 | 0.80 | ESR2 (0.55) | ESR2ESR1PKLRGALNT2GALNT1 | |
| SCHEMBL7987277 | 0.79 | ESR2 (0.70) | ESR2ESR1PKLRGALNT2GALNT1 | |
| SCHEMBL29370098 | 0.79 | PKLR (1.00) | ESR2ESR1PKLRGALNT2GALNT1 | |
| SCHEMBL7980209 | 0.79 | PKLR (1.00) | ESR2ESR1PKLRGALNT2GALNT1 | |
| SCHEMBL3874869 | 0.79 | ATP1A1 (0.74) | ESR2ESR1PKLRGALNT2GALNT1 | |
| SCHEMBL15285080 | 0.77 | KDM4E (0.61) | ESR2ESR1PKLRGALNT2GALNT1 | |
| SCHEMBL31414410 | 0.77 | KDM4E (0.61) | ESR2ESR1PKLRGALNT2GALNT1 | |
| SCHEMBL7982381 | 0.77 | PTGS2 (0.57) | ESR2ESR1KDM4EALDH1A1LMNA | |
| SCHEMBL6828285 | 0.76 | ESR2 (0.68) | ESR2ESR1PKLRGALNT2GALNT1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5104894-A | Ellagic acid analogues | UNIVERSITY OF GUELPH (CA) | 1992-04-14 | — | — | US | claimed |
| US-6194439-B1 | ANTICANCER AGENT | PFIZER INC. | 2001-02-27 | — | — | US | disclosed |
| EP-0586608-A1 | TRICYCLIC POLYHYDROXYLIC TYROSINE KINASE INHIBITORS | PFIZER INC. (US) | 1994-03-16 | — | — | EP | disclosed |
| WO-1992021660-A1 | TRICYCLIC POLYHYDROXYLIC TYROSINE KINASE INHIBITORS | PFIZER, INC. (US) | 1992-12-10 | — | — | WO | disclosed |
| US-5104894-A | Ellagic acid analogues | UNIVERSITY OF GUELPH (CA) | 1992-04-14 | — | — | US | disclosed |