Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.57 |
| ▸ | MME | P08473 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | TLR2 | O60603 | 1/20 | 0.52 |
| ▸ | CNR2 | P34972 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | FAAH | O00519 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL12352667 | 1.00 | LMNA (0.58) | LMNAMAPTMAPK1EPHX2MME | |
| SCHEMBL10026320 | 0.95 | MAPT (0.60) | LMNAMAPTMAPK1EPHX2MME | |
| SCHEMBL19152432 | 0.89 | MAPT (0.72) | LMNAMAPTMAPK1MMEALDH1A1 | |
| SCHEMBL8826260 | 0.86 | MME (0.58) | LMNAMAPTMAPK1EPHX2MME | |
| SCHEMBL8826267 | 0.86 | MME (0.58) | LMNAMAPTMAPK1EPHX2MME | |
| SCHEMBL10633050 | 0.86 | MAPT (0.53) | LMNAMAPTMAPK1EPHX2ALDH1A1 | |
| SCHEMBL3795974 | 0.84 | MMP3 (0.58) | EPHX2CYP3A4KMT2ATLR2TSHR | |
| SCHEMBL3803203 | 0.84 | MMP3 (0.58) | EPHX2CYP3A4KMT2ATLR2TSHR | |
| SCHEMBL20152030 | 0.84 | CA1 (0.57) | EPHX2KMT2ATLR2CNR2TSHR | |
| SCHEMBL17531100 | 0.84 | SPHK1 (0.64) | EPHX2KMT2ATLR2CNR2FAAH |
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-3786165-A1 | SYNTHETIC INTERMEDIATES FOR PRODUCING MACROCYCLES AS FACTOR XIA INHIBITORS | Bristol-Myers Squibb Company (US) | 2021-03-03 | — | — | EP | disclosed |
| EP-2534154-B1 | MACROCYCLES AS FACTOR XIA INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2020-08-05 | — | — | EP | disclosed |