Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH3 | Q9ULD8 | 4/20 | 0.60 |
| ▸ | SYK | P43405 | 1/20 | 0.56 |
| ▸ | VCP | P55072 | 6/20 | 0.55 |
| ▸ | LMNA | P02545 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.55 |
| ▸ | ESR1 | P03372 | 3/20 | 0.54 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | HRH1 | P35367 | 1/20 | 0.52 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.52 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.49 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.49 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL13127011 | 0.81 | MAPT (0.49) | SYKVCPMAPTSMN1; SMN2ESR1 | |
| SCHEMBL13329901 | 0.81 | LMNA (0.81) | KCNH3LMNAKDM4EMAPTHTT | |
| SCHEMBL3451953 | 0.81 | MAPT (0.51) | VCPLMNAMAPTSMN1; SMN2GAA | |
| SCHEMBL13329897 | 0.80 | ESR1 (0.64) | KCNH3LMNAKDM4EMAPTHTT | |
| SCHEMBL15871200 | 0.79 | MAPT (0.62) | SYKKDM4EMAPTSMN1; SMN2GAA | |
| SCHEMBL3450708 | 0.78 | ALDH1A1 (0.58) | VCPLMNAKDM4EMAPTSMN1; SMN2 | |
| SCHEMBL3451178 | 0.78 | HRH4 (0.55) | VCPLMNAKDM4EMAPTHTT | |
| SCHEMBL15757390 | 0.78 | HRH4 (0.74) | VCPSMN1; SMN2HRH1HRH4NPSR1 | |
| SCHEMBL18000520 | 0.78 | KCNH3 (0.57) | KCNH3LMNAKDM4EMAPTHTT | |
| SCHEMBL13456904 | 0.78 | VCP (0.48) | VCPHRH1HRH4 |
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 |