Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.31 |
| ▸ | KDR | P35968 | 1/20 | 0.31 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.31 |
| ▸ | RELA | Q04206 | 1/20 | 0.31 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.30 |
| ▸ | DHODH | Q02127 | 1/20 | 0.30 |
| ▸ | PPIA | P62937 | 1/20 | 0.30 |
| ▸ | PGR | P06401 | 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 | |
|---|---|---|---|---|
| SCHEMBL6313205 | 0.90 | PPIA (0.33) | IDO1AURKAKDRAURKBNPC1 | |
| SCHEMBL12017094 | 0.70 | HTR7 (0.45) | HTR7HTR2BPPIA | |
| SCHEMBL6308541 | 0.68 | HTR2A (0.33) | — | |
| SCHEMBL4415153 | 0.66 | LRRK2 (0.41) | HTR7IDO1KDRPGR | |
| SCHEMBL6312892 | 0.66 | HSD11B1 (0.35) | HTR7HTR2BIDO1 | |
| SCHEMBL4414735 | 0.64 | IDO1 (0.37) | HTR7HTR2BIDO1 | |
| Hydrochloric Acid SCHEMBL6306787 | 0.63 | IDO1 (0.36) | HTR7HTR2BIDO1 | |
| SCHEMBL22336280 | 0.61 | HTR2B (0.47) | HTR7HTR2BIDO1PPIAPGR | |
| SCHEMBL22336279 | 0.61 | HTR2B (0.47) | HTR7HTR2BIDO1PPIAPGR | |
| SCHEMBL18634612 | 0.60 | DAO (0.42) | PGR |
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 |
|---|---|---|---|---|---|---|---|
| US-6958330-B1 | Polycyclic α-amino-ε-caprolactams and related compounds | ELAN PHARMACEUTICALS, INC. (US) | 2005-10-25 | — | — | US | disclosed |