Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | IMPDH2 | P12268 | 4/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL25625860 | 1.00 | CYP1A2 (0.44) | CYP1A2CYP2A6KDM4EALDH1A1LMNA | |
| SCHEMBL13615236 | 1.00 | CYP1A2 (0.44) | CYP1A2CYP2A6KDM4EALDH1A1LMNA | |
| SCHEMBL19321774 | 0.98 | CYP1A2 (0.46) | CYP1A2CYP2A6KDM4EALDH1A1LMNA | |
| SCHEMBL19321773 | 0.85 | HIPK2 (0.53) | CYP1A2CYP2A6KDM4EALDH1A1LMNA | |
| SCHEMBL597341 | 0.81 | CYP1A2 (0.67) | CYP1A2CYP2A6KDM4EALDH1A1LMNA | |
| SCHEMBL30969150 | 0.79 | CYP2A6 (0.59) | CYP1A2CYP2A6ALDH1A1ACHEIMPDH2 | |
| SCHEMBL2616771 | 0.79 | CYP2A6 (0.59) | CYP1A2CYP2A6ALDH1A1ACHEIMPDH2 | |
| SCHEMBL761399 | 0.79 | CYP2A6 (0.56) | CYP1A2CYP2A6ALDH1A1ACHEIMPDH2 | |
| SCHEMBL30824503 | 0.79 | CYP2A6 (0.56) | CYP1A2CYP2A6ALDH1A1ACHEIMPDH2 | |
| SCHEMBL12532558 | 0.79 | IMPDH2 (0.50) | CYP1A2KDM4EALDH1A1LMNAHSD17B10 |
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-7611863-B2 | Selective staining of biomembranes using voltage-sensitive dyes | MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E.V. (DE) | 2009-11-03 | — | — | US | disclosed |