Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 1/20 | 0.43 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.43 |
| ▸ | NOTUM | Q6P988 | 8/20 | 0.41 |
| ▸ | DPP4 | P27487 | 6/20 | 0.41 |
| ▸ | IDH2 | P48735 | 1/20 | 0.41 |
| ▸ | KHK | P50053 | 1/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.38 |
| ▸ | SUV39H2 | Q9H5I1 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22186379 | 0.85 | NOTUM (0.45) | PIM1PIM2NOTUMDPP4IDH2 | |
| Hydrochloric Acid SCHEMBL28605683 | 0.84 | NOTUM (0.44) | PIM1PIM2NOTUMDPP4IDH2 | |
| Hydrochloric Acid SCHEMBL28605682 | 0.84 | NOTUM (0.44) | PIM1PIM2NOTUMDPP4IDH2 | |
| SCHEMBL14637786 | 0.78 | NOTUM (0.46) | NOTUM | |
| SCHEMBL14638309 | 0.77 | NOTUM (0.52) | PIM1NOTUMIDH2HRH4 | |
| SCHEMBL14650198 | 0.77 | NOTUM (0.52) | PIM1NOTUMIDH2HRH4 | |
| SCHEMBL21624735 | 0.77 | NOTUM (0.52) | PIM1NOTUMIDH2HRH4 | |
| SCHEMBL22186378 | 0.76 | NOTUM (0.50) | NOTUMDPP4KHKHRH4 | |
| SCHEMBL7468709 | 0.76 | PRKD3 (0.45) | PIM1NOTUMDPP4 | |
| SCHEMBL9310553 | 0.75 | IDH2 (0.59) | PIM1NOTUMIDH2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013012827-A1 | DIAMINOCYCLOHEXANE COMPOUNDS AND USES THEREOF | BRISTOL-MYERS SQUIBB COMPANY (US) | 2013-01-24 | — | — | WO | disclosed |