Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.73 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.73 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.50 |
| ▸ | NCF1 | P14598 | 1/20 | 0.50 |
| ▸ | APP | P05067 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | PRSS1 | P07477 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL23493022 | 1.00 | CYP1A2 (0.73) | CYP1A2CYP2C9CYP2C19ALDH1A1TDP1 | |
| SCHEMBL865680 | 1.00 | CYP1A2 (0.73) | CYP1A2CYP2C9CYP2C19ALDH1A1TDP1 | |
| SCHEMBL867259 | 1.00 | CYP1A2 (0.73) | CYP1A2CYP2C9CYP2C19ALDH1A1TDP1 | |
| SCHEMBL29502067 | 1.00 | CYP1A2 (0.73) | CYP1A2CYP2C9CYP2C19ALDH1A1TDP1 | |
| SCHEMBL23493019 | 1.00 | CYP1A2 (0.73) | CYP1A2CYP2C9CYP2C19ALDH1A1TDP1 | |
| SCHEMBL10804708 | 1.00 | CYP1A2 (0.73) | CYP1A2CYP2C9CYP2C19ALDH1A1TDP1 | |
| SCHEMBL23493031 | 1.00 | CYP1A2 (0.73) | CYP1A2CYP2C9CYP2C19ALDH1A1TDP1 | |
| SCHEMBL10387995 | 0.98 | CYP1A2 (0.76) | CYP1A2CYP2C9CYP2C19ALDH1A1TDP1 | |
| SCHEMBL10386552 | 0.93 | CYP1A2 (0.76) | CYP1A2CYP2C9CYP2C19ALDH1A1TDP1 | |
| Hydrochloric Acid SCHEMBL11038494 | 0.91 | CYP1A2 (0.73) | CYP1A2CYP2C9CYP2C19ALDH1A1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2152660-A2 | PHOTOCROSSLINKABLE MATERIALS COMPRISING ALICYCLIC GROUP | Rolic AG (CH) | 2010-02-17 | — | — | EP | disclosed |
| WO-2008145225-A2 | PHOTOCROSSLINKABLE MATERIALS COMPRISING ALICYCLIC GROUP | ROLIC AG (CH) | 2008-12-04 | — | — | WO | disclosed |