Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | KDM1A | O60341 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | CDC7 | O00311 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | ESRRG | P62508 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2819525 | 0.86 | NPC1 (0.52) | HDAC1PTGS2KDM1ANOTUMESRRG | |
| SCHEMBL18925110 | 0.84 | CYP19A1 (0.53) | SIGMAR1LMNAALDH1A1 | |
| SCHEMBL2819878 | 0.84 | TEK (0.49) | HDAC1KDM1AMAPTNOTUM | |
| SCHEMBL18922487 | 0.84 | KDM1A (0.43) | SIGMAR1KCNH2HDAC1PTGS2KDM1A | |
| SCHEMBL28080410 | 0.75 | SIGMAR1 (0.56) | SIGMAR1KCNH2HDAC1PTGS2KDM1A | |
| SCHEMBL755146 | 0.74 | KDM5B (0.47) | — | |
| SCHEMBL17961115 | 0.73 | HDAC1 (0.51) | SIGMAR1KCNH2HDAC1PTGS2KDM1A | |
| SCHEMBL20644440 | 0.73 | ESRRG (0.50) | HDAC1NOTUMESRRG | |
| SCHEMBL18460628 | 0.73 | IDO1 (0.41) | NOTUM | |
| SCHEMBL20445146 | 0.73 | IDO1 (0.41) | NOTUM |
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 |
|---|---|---|---|---|---|---|---|
| US-9670247-B2 | Contraceptive agents | THE UNIVERSITY OF KANSAS (US) | 2017-06-06 | — | — | US | disclosed |