Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.78 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.78 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.78 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.78 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.63 |
| ▸ | GAA | P10253 | 6/20 | 0.55 |
| ▸ | MAPT | P10636 | 5/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.44 |
| ▸ | FER | P16591 | 1/20 | 0.44 |
| ▸ | LTK | P29376 | 1/20 | 0.44 |
| ▸ | CDK8 | P49336 | 1/20 | 0.44 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.44 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.44 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL9178250 | 0.88 | ALDH1A1 (1.00) | ALDH1A1ALOX15MAPK10HSD17B10L3MBTL1 | |
| SCHEMBL2592634 | 0.80 | ALOX15 (0.66) | ALDH1A1ALOX15MAPK10HSD17B10L3MBTL1 | |
| SCHEMBL11340729 | 0.79 | MAPT (0.61) | ALDH1A1ALOX15MAPK10HSD17B10L3MBTL1 | |
| SCHEMBL8988 | 0.78 | L3MBTL1 (1.00) | ALDH1A1ALOX15MAPK10HSD17B10L3MBTL1 | |
| SCHEMBL9101431 | 0.73 | LMNA (0.58) | ALDH1A1ALOX15MAPK10HSD17B10MAPT | |
| SCHEMBL9221847 | 0.73 | ALDH1A1 (0.68) | ALDH1A1ALOX15MAPK10HSD17B10L3MBTL1 | |
| SCHEMBL9177525 | 0.73 | ALDH1A1 (0.68) | ALDH1A1ALOX15MAPK10HSD17B10L3MBTL1 | |
| SCHEMBL5937366 | 0.71 | CYP1A2 (1.00) | ALDH1A1ALOX15MAPK10HSD17B10L3MBTL1 | |
| SCHEMBL2575044 | 0.71 | MAPT (1.00) | ALDH1A1ALOX15MAPK10HSD17B10L3MBTL1 | |
| SCHEMBL2420515 | 0.70 | CYP1A2 (0.77) | ALDH1A1ALOX15MAPK10HSD17B10GAA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5550122-A | INHIBIT REVERSE TRANSCRIPTASE | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 1996-08-27 | — | — | US | disclosed |
| EP-0415303-B1 | Pyrido [2,3-b][1,5]benzoxazepin (and thiazepin)-5(6H)-ones and -thiones and their use in the prevention or treatment of HIV infection | BOEHRINGER INGELHEIM PHARMA (US) | 1995-12-13 | — | — | EP | disclosed |
| EP-0415303-A2 | Pyrido [2,3-b][1,5]benzoxazepin (and thiazepin)-5(6H)-ones and -thiones and their use in the prevention or treatment of HIV infection | BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) | 1991-03-06 | — | — | EP | disclosed |