Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCL2A1 | Q16548 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KHK | P50053 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | GHSR | Q92847 | 2/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.33 |
| ▸ | KIT | P10721 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8107811 | 0.90 | BCL2A1 (0.42) | BCL2A1MAPTKHKALDH1A1KDM4E | |
| SCHEMBL4589544 | 0.78 | BCL2A1 (0.44) | BCL2A1MAPTKHKALDH1A1LMNA | |
| SCHEMBL8114412 | 0.78 | BCL2A1 (0.44) | BCL2A1MAPTKHKALDH1A1KDM4E | |
| SCHEMBL8097204 | 0.78 | BCL2A1 (0.44) | BCL2A1MAPTKHKALDH1A1LMNA | |
| SCHEMBL4589715 | 0.78 | BCL2A1 (0.44) | BCL2A1MAPTKHKALDH1A1KDM4E | |
| SCHEMBL4590454 | 0.74 | NPC1 (0.40) | MAPTPSMB5 | |
| SCHEMBL4588676 | 0.71 | MAPT (0.47) | BCL2A1MAPTKHKALDH1A1LMNA | |
| SCHEMBL4588673 | 0.71 | MAPT (0.47) | BCL2A1MAPTKHKALDH1A1LMNA | |
| SCHEMBL30532067 | 0.70 | ALDH1A1 (0.64) | BCL2A1KHKALDH1A1KDM4EHPGD | |
| SCHEMBL4240000 | 0.70 | HTR3E (0.61) | BCL2A1MAPTKHKALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009001127-A1 | CYANOCYCLOPROPYLCARBOXAMIDES AS CATHEPSIN INHIBITORS | ASTRAZENECA AB (SE) | 2008-12-31 | — | — | WO | disclosed |