Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.48 |
| ▸ | DNM2 | P50570 | 11/20 | 0.47 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.39 |
| ▸ | SOAT1 | P35610 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13329915 | 1.00 | ESR1 (0.48) | ESR1ESR2DNM2TLR8SOAT1 | |
| SCHEMBL13329917 | 0.82 | DNM2 (0.63) | DNM2TLR8SOAT1 | |
| SCHEMBL13329923 | 0.82 | DNM2 (0.63) | DNM2TLR8SOAT1 | |
| SCHEMBL13329938 | 0.81 | ESR1 (0.72) | ESR1ESR2DNM2TLR8 | |
| SCHEMBL13329934 | 0.81 | ESR1 (0.72) | ESR1ESR2DNM2TLR8 | |
| SCHEMBL13329974 | 0.80 | ESR1 (0.44) | ESR1ESR2 | |
| SCHEMBL13329943 | 0.78 | ESR1 (0.78) | ESR1ESR2DNM2TLR8 | |
| SCHEMBL13329962 | 0.78 | ESR1 (0.60) | ESR1ESR2DNM2TLR8SOAT1 | |
| SCHEMBL13329941 | 0.75 | ESR1 (0.59) | ESR1ESR2DNM2 | |
| SCHEMBL13329891 | 0.72 | KCNH3 (0.63) | ESR1ESR2DNM2TLR8SOAT1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7722893-B2 | Use of substitute 2,4-bis (alkylamino) pyrimidines or quinzolines as antimicrobials | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 2010-05-25 | — | — | US | disclosed |
| US-7722893-B2 | Use of substitute 2,4-bis (alkylamino) pyrimidines or quinzolines as antimicrobials | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 2010-05-25 | — | — | US | disclosed |