Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | VDR | P11473 | 1/20 | 0.30 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL9612420 | 0.90 | CYP1A2 (0.36) | SIGMAR1CYP1A2TDP1NR1I2LMNA | |
| SCHEMBL9612356 | 0.86 | ALDH1A1 (0.33) | ALDH1A1HSD17B10 | |
| SCHEMBL9612404 | 0.83 | ALDH1A1 (0.33) | ALDH1A1HSD17B10 | |
| SCHEMBL13249052 | 0.81 | CYP1A2 (0.38) | SIGMAR1CYP1A2TDP1NR1I2LMNA | |
| SCHEMBL13511241 | 0.80 | ACHE (0.44) | SIGMAR1CYP1A2TDP1NR1I2LMNA | |
| SCHEMBL29555509 | 0.80 | ACHE (0.44) | SIGMAR1CYP1A2TDP1NR1I2LMNA | |
| SCHEMBL984147 | 0.78 | SIGMAR1 (0.38) | SIGMAR1LMNACYP3A4MAPTCYP2C9 | |
| SCHEMBL5144122 | 0.78 | ACHE (0.42) | SIGMAR1CYP1A2TDP1NR1I2LMNA | |
| SCHEMBL12714975 | 0.77 | SIGMAR1 (0.43) | SIGMAR1CYP1A2TDP1NR1I2LMNA | |
| SCHEMBL9612350 | 0.77 | SOS1 (0.42) | CYP1A2LMNACYP2C9MAPK1CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2148909-B1 | BENZANTHRACENE DERIVATIVES FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2012-05-30 | — | — | EP | disclosed |