Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | MPO | P05164 | 1/20 | 0.40 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | TACR3 | P29371 | 4/20 | 0.37 |
| ▸ | STAT3 | P40763 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | GUSB | P08236 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HBB | P68871 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7396607 | 0.80 | SMPD3 (0.42) | KDM4EALDH1A1SMN1; SMN2MPOTLR8 | |
| SCHEMBL8139912 | 0.77 | NPSR1 (0.54) | KDM4EALDH1A1SMN1; SMN2NPSR1MPO | |
| SCHEMBL7396622 | 0.77 | MPO (0.42) | KDM4EALDH1A1SMN1; SMN2NPSR1MPO | |
| SCHEMBL31429628 | 0.76 | MGAM (0.52) | KDM4ESMN1; SMN2NPSR1ADORA2AGAA | |
| SCHEMBL12732312 | 0.76 | KDM4E (0.58) | KDM4EALDH1A1SMN1; SMN2NPSR1TACR3 | |
| SCHEMBL6809754 | 0.76 | KDM4E (0.46) | KDM4EALDH1A1SMN1; SMN2NPSR1MPO | |
| SCHEMBL8161422 | 0.76 | RAC1 (0.52) | KDM4EALDH1A1SMN1; SMN2NPSR1TLR8 | |
| SCHEMBL8139843 | 0.75 | ACP1 (0.43) | KDM4EALDH1A1SMN1; SMN2NPSR1MPO | |
| SCHEMBL7396057 | 0.75 | SMN1; SMN2 (0.45) | KDM4EALDH1A1SMN1; SMN2NPSR1MPO | |
| SCHEMBL31429583 | 0.75 | GAA (0.53) | KDM4EALDH1A1SMN1; SMN2NPSR1HPGD |
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-1169339-A1 | MACROCYCLIC PEPTIDES INHIBITING THE HEPATITIS C VIRUS NS3 PROTEASE | BOEHRINGER INGELHEIM (CANADA) LTD. (CA) | 2002-01-09 | — | — | EP | disclosed |
| WO-2000059929-A1 | MACROCYCLIC PEPTIDES ACTIVE AGAINST THE HEPATITIS C VIRUS | BOEHRINGER INGELHEIM (CANADA) LTD. (CA) | 2000-10-12 | — | — | WO | disclosed |