Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL903082 | 0.77 | ALDH1A1 (0.33) | TSHRMEN1KMT2AALDH1A1POLB | |
| SCHEMBL12021938 | 0.72 | SMN1; SMN2 (0.34) | TSHRMEN1KMT2AALDH1A1POLB | |
| SCHEMBL903086 | 0.70 | LMNA (0.34) | MEN1KMT2AALDH1A1 | |
| SCHEMBL903056 | 0.69 | — | — | |
| SCHEMBL10082089 | 0.68 | KDM4E (0.31) | — | |
| SCHEMBL903089 | 0.67 | GAA (0.34) | TSHRMEN1KMT2AALDH1A1POLB | |
| SCHEMBL903094 | 0.66 | — | — | |
| SCHEMBL902940 | 0.66 | GAA (0.33) | TSHRMEN1KMT2AALDH1A1 | |
| SCHEMBL902650 | 0.66 | GAA (0.33) | TSHRMEN1KMT2AALDH1A1 | |
| SCHEMBL903083 | 0.65 | CYP2C9 (0.36) | MEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |