Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.47 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.47 |
| ▸ | MAPK7 | Q13164 | 5/20 | 0.38 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.38 |
| ▸ | DCLK1 | O15075 | 2/20 | 0.38 |
| ▸ | BRD4 | O60885 | 7/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.35 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.33 |
| ▸ | IDH1 | O75874 | 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 | |
|---|---|---|---|---|
| SCHEMBL8548089 | 0.84 | ALDH1A1 (0.41) | ALDH1A1LMNAPOLBADORA3MAPK1 | |
| SCHEMBL8305521 | 0.81 | ALDH1A1 (0.47) | ALDH1A1LMNAPOLBADORA3MAPK1 | |
| SCHEMBL8300415 | 0.80 | CYP3A4 (0.45) | MAPK7LRRK2DCLK1BRD4IDH1 | |
| SCHEMBL8547811 | 0.79 | MTOR (0.42) | ALDH1A1LMNAPOLBADORA3MAPK1 | |
| SCHEMBL8546272 | 0.79 | ALDH1A1 (0.43) | ALDH1A1LMNAPOLBADORA3MAPK1 | |
| SCHEMBL12427418 | 0.78 | ALDH1A1 (0.51) | ALDH1A1LMNAPOLBADORA3MAPK1 | |
| SCHEMBL8299602 | 0.73 | ALDH1A1 (0.69) | ALDH1A1LMNAPOLBADORA3MAPK1 | |
| SCHEMBL13915889 | 0.73 | ALDH1A1 (0.63) | ALDH1A1LMNAPOLBADORA3MAPK1 | |
| SCHEMBL8418964 | 0.70 | KDM4E (0.40) | ALDH1A1LMNAPOLBADORA3ADORA2A | |
| SCHEMBL8339203 | 0.70 | KDM4E (0.37) | ALDH1A1LMNAPOLBADORA3ADORA2A |
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-0429987-B1 | 5,11-Dihydro-6H-dipyrido[3,2-b:2',3'-e] [1,4]diazepines and their use in the prevention or treatment of HIV infection | BOEHRINGER INGELHEIM PHARMA (US) | 1999-03-17 | — | — | EP | claimed |
| EP-0429987-B1 | 5,11-Dihydro-6H-dipyrido[3,2-b:2',3'-e] [1,4]diazepines and their use in the prevention or treatment of HIV infection | BOEHRINGER INGELHEIM PHARMA (US) | 1999-03-17 | — | — | EP | disclosed |
| EP-0900214-A1 | PROCESS FOR PREPARATION OF PYRIMIDINE DERIVATIVES | Yuhan Corporation (KR) | 1999-03-10 | — | — | EP | disclosed |
| WO-1997042186-A1 | PROCESS FOR PREPARATION OF PYRIMIDINE DERIVATIVES | YUHAN CORPORATION (KR) | 1997-11-13 | — | — | WO | disclosed |