Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.69 |
| ▸ | LMNA | P02545 | 6/20 | 0.69 |
| ▸ | HTT | P42858 | 2/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.68 |
| ▸ | TSHR | P16473 | 3/20 | 0.68 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.68 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.68 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.64 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.64 |
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.61 |
| ▸ | USP2 | O75604 | 1/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL17461660 | 0.94 | KDM4E (0.67) | KDM4ELMNAHTTALDH1A1TSHR | |
| SCHEMBL17461657 | 0.90 | KDM4E (0.61) | KDM4ELMNAHTTALDH1A1TSHR | |
| SCHEMBL17461658 | 0.90 | NPC1 (0.63) | KDM4ELMNAHTTALDH1A1TSHR | |
| SCHEMBL898932 | 0.87 | LMNA (0.71) | KDM4ELMNAHTTALDH1A1TSHR | |
| SCHEMBL10082420 | 0.86 | TSHR (0.54) | KDM4ELMNAHTTALDH1A1TSHR | |
| SCHEMBL12691835 | 0.85 | LMNA (0.69) | KDM4ELMNAHTTALDH1A1TSHR | |
| SCHEMBL457976 | 0.84 | LMNA (0.70) | KDM4ELMNAHTTALDH1A1TSHR | |
| SCHEMBL899570 | 0.83 | LMNA (0.67) | KDM4ELMNAHTTALDH1A1TSHR | |
| SCHEMBL17461649 | 0.83 | KDM4E (0.64) | KDM4ELMNAHTTALDH1A1TSHR | |
| SCHEMBL12691740 | 0.81 | LMNA (0.67) | KDM4ELMNAHTTALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2621920-B1 | NOVEL PIPERAZINE ANALOGS WITH SUBSTITUTED HETEROARYL GROUPS AS BROAD-SPECTRUM INFLUENZA ANTIVIRALS | BRISTOL MYERS SQUIBB CO (US) | 2016-01-27 | — | — | EP | disclosed |
| WO-2012044531-A1 | NOVEL PIPERAZINE ANALOGS WITH SUBSTITUTED HETEROARYL GROUPS AS BROAD-SPECTRUM INFLUENZA ANTIVIRALS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-04-05 | — | — | WO | disclosed |