Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.59 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.59 |
| ▸ | DNM2 | P50570 | 11/20 | 0.54 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CCR4 | P51679 | 1/20 | 0.40 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.40 |
| ▸ | IGF1R | P08069 | 1/20 | 0.39 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.38 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL13329938 | 0.89 | ESR1 (0.72) | ESR1ESR2DNM2TP53KMT2A | |
| SCHEMBL13329934 | 0.89 | ESR1 (0.72) | ESR1ESR2DNM2TP53KMT2A | |
| SCHEMBL13329943 | 0.87 | ESR1 (0.78) | ESR1ESR2DNM2TP53KMT2A | |
| SCHEMBL13329962 | 0.81 | ESR1 (0.60) | ESR1ESR2DNM2TP53ALDH1A1 | |
| SCHEMBL13329958 | 0.81 | TP53 (0.69) | DNM2TP53IGF1RPDCD1CD274 | |
| SCHEMBL13329940 | 0.77 | ESR1 (0.64) | ESR1ESR2DNM2TP53KMT2A | |
| SCHEMBL13329944 | 0.76 | DNM2 (0.47) | ESR1ESR2DNM2KMT2AHTT | |
| SCHEMBL13329942 | 0.75 | DNM2 (0.52) | ESR1ESR2DNM2KMT2A | |
| SCHEMBL13329894 | 0.75 | KCNH3 (0.63) | ESR1ESR2DNM2TP53ALDH1A1 | |
| SCHEMBL13329891 | 0.75 | KCNH3 (0.63) | ESR1ESR2DNM2TP53ALDH1A1 |
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 |