Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.42 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | HCAR3 | P49019 | 3/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.38 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.38 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.38 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.36 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | GRM5 | P41594 | 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 | |
|---|---|---|---|---|
| SCHEMBL7429834 | 1.00 | CHRNB2 (0.42) | CHRNB2CHRNB4CHRNA3CHRNA4EPHX2 | |
| SCHEMBL30797267 | 0.79 | HCAR3 (0.43) | CHRNB2CHRNB4CHRNA3CHRNA4EPHX2 | |
| SCHEMBL29416422 | 0.79 | SMN1; SMN2 (0.44) | CHRNB2CHRNB4CHRNA3CHRNA4EPHX2 | |
| SCHEMBL890246 | 0.78 | CHRNB2 (0.38) | CHRNB2CHRNB4CHRNA3CHRNA4EPHX2 | |
| SCHEMBL5555518 | 0.77 | HCAR3 (0.42) | HCAR3MAPKAPK2PIK3CDPIK3R1MKNK1 | |
| SCHEMBL503092 | 0.77 | POLB (0.55) | ALDH1A1 | |
| SCHEMBL44234 | 0.77 | POLB (0.55) | ALDH1A1 | |
| SCHEMBL6811033 | 0.77 | POLB (0.55) | ALDH1A1 | |
| SCHEMBL44233 | 0.77 | POLB (0.55) | ALDH1A1 | |
| SCHEMBL890146 | 0.77 | EPHX2 (0.40) | CHRNB2CHRNB4CHRNA3CHRNA4EPHX2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002008206-A1 | 3-AMINO-2-(4-AMINOCARBONYLOXY)PHENYL-PROPIONIC ACID DERIVATIVES AS ALPHA-4- INTEGRIN INHIBITORS | ELAN PHARMACEUTICALS, INC. (US) | 2002-01-31 | — | — | WO | disclosed |
| EP-0587799-B1 | INHIBITORS OF CATHEPSIN G AND ELASTASE FOR PREVENTING CONNECTIVE TISSUE DEGRADATION | MERRELL PHARMA INC (US) | 1999-07-07 | — | — | EP | disclosed |