Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.47 |
| ▸ | MPI | P34949 | 1/20 | 0.47 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.47 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.47 |
| ▸ | MAPK7 | Q13164 | 4/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | BRD4 | O60885 | 4/20 | 0.43 |
| ▸ | DCLK1 | O15075 | 3/20 | 0.43 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | DRD2 | P14416 | 2/20 | 0.43 |
| ▸ | HTR6 | P50406 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9369781 | 0.89 | TNK2 (0.42) | ALDH1A1SMN1; SMN2HPGDCASP1MPI | |
| SCHEMBL16979656 | 0.85 | BRD4 (0.52) | ALDH1A1HPGDCACNA1BAPBA1MAPK7 | |
| SCHEMBL8546607 | 0.84 | L3MBTL1 (0.42) | ALDH1A1SMN1; SMN2HPGDCASP1MPI | |
| SCHEMBL20094162 | 0.82 | MAPK7 (0.51) | ALDH1A1SMN1; SMN2HPGDCASP1MPI | |
| SCHEMBL9370046 | 0.80 | BRD4 (0.48) | ALDH1A1SMN1; SMN2HPGDCASP1MPI | |
| SCHEMBL19496544 | 0.78 | MAPK7 (0.52) | ALDH1A1SMN1; SMN2HPGDCASP1MPI | |
| SCHEMBL21311761 | 0.77 | MAPT (0.67) | ALDH1A1SMN1; SMN2HPGDCASP1MPI | |
| SCHEMBL22473980 | 0.74 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2HPGDCASP1MPI | |
| SCHEMBL8889357 | 0.73 | CYP3A4 (0.42) | L3MBTL1BRD4 | |
| SCHEMBL8791127 | 0.71 | BRD4 (0.48) | ALDH1A1SMN1; SMN2HPGDCASP1MPI |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0393530-B1 | 5,11-dihydro-6H-pyrido[2,3,-b][1,4]benzodiazepin-6-ones and -thiones and their use in the prevention or treatment of AIDS | BOEHRINGER INGELHEIM PHARMA (US) | 1994-12-28 | — | — | EP | claimed |
| EP-0393530-A1 | 5,11-dihydro-6H-pyrido[2,3,-b][1,4]benzodiazepin-6-ones and -thiones and their use in the prevention or treatment of AIDS | BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) | 1990-10-24 | — | — | EP | claimed |
| EP-0393530-B1 | 5,11-dihydro-6H-pyrido[2,3,-b][1,4]benzodiazepin-6-ones and -thiones and their use in the prevention or treatment of AIDS | BOEHRINGER INGELHEIM PHARMA (US) | 1994-12-28 | — | — | EP | disclosed |
| US-5087625-A | Pyridodiazepines and their use in the prevention or treatment of HIV infection | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 1992-02-11 | — | — | US | disclosed |
| EP-0393530-A1 | 5,11-dihydro-6H-pyrido[2,3,-b][1,4]benzodiazepin-6-ones and -thiones and their use in the prevention or treatment of AIDS | BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) | 1990-10-24 | — | — | EP | disclosed |