Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NOS2 | P35228 | 1/20 | 0.34 |
| ▸ | SLC19A2 | O60779 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | SREBF2 | Q12772 | 7/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL27592765 | 0.86 | KDM4E (0.42) | TLR8KDM4ELMNACYP3A4TSHR | |
| Ammonia Solution, Strong SCHEMBL27648732 | 0.84 | KDM4E (0.41) | TLR8KDM4ELMNACYP3A4TSHR | |
| SCHEMBL16248159 | 0.84 | KDM4E (0.37) | TLR8KDM4ELMNACYP3A4TSHR | |
| SCHEMBL14424238 | 0.81 | SORD (0.31) | — | |
| SCHEMBL16815708 | 0.81 | KDM4E (0.39) | TLR8KDM4ELMNACYP3A4TSHR | |
| SCHEMBL20109822 | 0.78 | LMNA (0.40) | LMNANOS2TDP1ALDH1A1L3MBTL1 | |
| SCHEMBL14234022 | 0.77 | KCNH2 (0.41) | TLR8KDM4ELMNACYP3A4TSHR | |
| SCHEMBL15196257 | 0.76 | NOS2 (0.36) | TLR8KDM4ELMNACYP3A4TSHR | |
| SCHEMBL8176767 | 0.76 | KDM4E (0.37) | TLR8KDM4ELMNACYP3A4TSHR | |
| SCHEMBL20109474 | 0.74 | MTNR1A (0.39) | KDM4ETDP1HPGDNPC1PDE3B |
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 |
|---|---|---|---|---|---|---|---|
| EP-2534152-B1 | MACROCYCLES AS FACTOR XIA INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2018-05-02 | — | — | EP | disclosed |