Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 12/20 | 0.56 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.45 |
| ▸ | RARA | P10276 | 1/20 | 0.39 |
| ▸ | RARB | P10826 | 1/20 | 0.39 |
| ▸ | RARG | P13631 | 1/20 | 0.39 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3426749 | 0.84 | AKR1B1 (0.55) | AKR1B1AKR1B10MAPTAKR1A1CTNNB1 | |
| SCHEMBL3424941 | 0.77 | AKR1B1 (0.51) | AKR1B1AKR1B10MAPTAKR1A1RARA | |
| SCHEMBL13761822 | 0.77 | AKR1B1 (0.47) | AKR1B1AKR1B10MAPTAKR1A1RARA | |
| SCHEMBL3426706 | 0.75 | AKR1B1 (0.48) | AKR1B1AKR1B10MAPTAKR1A1RARA | |
| SCHEMBL3428327 | 0.73 | AKR1B1 (0.46) | AKR1B1AKR1B10MAPTAKR1A1KIF11 | |
| SCHEMBL12188672 | 0.73 | AKR1B1 (0.57) | AKR1B1AKR1B10MAPTAKR1A1RARA | |
| SCHEMBL4456598 | 0.72 | AKR1B1 (0.45) | AKR1B1AKR1B10MAPTAKR1A1RARA | |
| SCHEMBL8794386 | 0.71 | AKR1B1 (0.70) | AKR1B1AKR1B10MAPTAKR1A1 | |
| SCHEMBL3424437 | 0.71 | AKR1B1 (0.47) | AKR1B1AKR1B10MAPTAKR1A1RARA | |
| SCHEMBL17729307 | 0.70 | AKR1B1 (0.55) | AKR1B1AKR1B10MAPTAKR1A1RARA |
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 |
|---|---|---|---|---|---|---|---|
| US-7795272-B2 | Glucocorticoid mimetics, methods of making them, pharmaceutical compositions and uses thereof | BOEHRINGER INGELHEIM PHARMACEUTICAL, INC. (US) | 2010-09-14 | — | — | US | disclosed |
| US-7579469-B2 | Glucocorticoid mimetics, methods of making them, pharmaceutical compositions, and uses thereof | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 2009-08-25 | — | — | US | disclosed |