Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROS1 | P08922 | 1/20 | 0.36 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 3/20 | 0.35 |
| ▸ | CNR1 | P21554 | 2/20 | 0.35 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | CDK8 | P49336 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | CDK7 | P50613 | 1/20 | 0.34 |
| ▸ | CDK9 | P50750 | 1/20 | 0.34 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3676496 | 0.76 | KDM4E (0.36) | ROS1RPS6KB1KDM4EMAPKAPK2IDO1 | |
| SCHEMBL27967472 | 0.75 | AOC3 (0.50) | KDM4EALDH1A1RAB9AMAPTAOC3 | |
| SCHEMBL3672089 | 0.74 | AOC3 (0.44) | ROS1RPS6KB1KDM4EMAPKAPK2ALDH1A1 | |
| SCHEMBL27598089 | 0.73 | KDM4E (0.58) | KDM4EMAPKAPK2ALDH1A1CNR2CNR1 | |
| Alcohol SCHEMBL3675269 | 0.72 | OPRM1 (0.34) | ROS1RPS6KB1KDM4EMAPKAPK2ALDH1A1 | |
| SCHEMBL3971384 | 0.70 | KDM4E (0.43) | KDM4EMAPKAPK2ALDH1A1RAB9AMAPT | |
| SCHEMBL17028220 | 0.69 | KDM4E (0.41) | ROS1RPS6KB1KDM4EMAPKAPK2ALDH1A1 | |
| SCHEMBL423788 | 0.68 | AOC3 (0.49) | KDM4EALDH1A1RAB9AMAPTAOC3 | |
| SCHEMBL12071539 | 0.66 | AOC3 (0.47) | KDM4EALDH1A1RAB9AMAPTAOC3 | |
| SCHEMBL422232 | 0.66 | AOC3 (0.47) | KDM4EALDH1A1RAB9AMAPTAOC3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1320367-A4 | PROCESS FOR THE PREPARATION OF DINAPSOLINE | PURDUE RESEARCH FOUNDATION (US) | 2007-01-17 | — | — | EP | disclosed |
| US-6645975-B1 | Reducing, deprotecting and optionally alkylating chemical intermediates to form 8,9-dihydroxy-2,3,7,11b-tetrahydro-1H-naphtho(1,2,3-de)isoquinoline, used as dopamine receptor agonists | PURDUE RESEARCH FOUNDATION | 2003-11-11 | — | — | US | disclosed |
| EP-1320367-A1 | PROCESS FOR THE PREPARATION OF DINAPSOLINE | PURDUE RESEARCH FOUNDATION (US) | 2003-06-25 | — | — | EP | disclosed |
| WO-2002013827-A1 | PROCESS FOR THE PREPARATION OF DINAPSOLINE | PURDUE RESEARCH FOUNDATION (US) | 2002-02-21 | — | — | WO | disclosed |