Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 8/20 | 0.56 |
| ▸ | PTGS1 | P23219 | 6/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | GCK | P35557 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL972533 | 0.87 | KDM4E (0.53) | PTGS2PTGS1KDM4EMEN1KMT2A | |
| SCHEMBL973305 | 0.86 | ALDH1A1 (0.55) | PTGS2PTGS1KDM4EMEN1KMT2A | |
| Ammonia Solution, Strong SCHEMBL3402419 | 0.84 | ALDH1A1 (0.53) | PTGS2PTGS1KDM4EMEN1KMT2A | |
| SCHEMBL7993153 | 0.83 | SMN1; SMN2 (0.60) | PTGS2PTGS1KDM4EMEN1KMT2A | |
| SCHEMBL940743 | 0.83 | PTGS2 (0.57) | PTGS2PTGS1KDM4EGPR119 | |
| SCHEMBL1477426 | 0.83 | PTGS2 (0.57) | PTGS2PTGS1KDM4ERAB9AALDH1A1 | |
| SCHEMBL29504605 | 0.83 | KDM4E (0.59) | PTGS2PTGS1KDM4EMEN1KMT2A | |
| SCHEMBL19435036 | 0.83 | KDM4E (0.59) | PTGS2PTGS1KDM4EMEN1KMT2A | |
| SCHEMBL8737052 | 0.82 | KDM4E (0.66) | KDM4EMEN1KMT2ANPC1RAB9A | |
| SCHEMBL3402420 | 0.82 | ALDH1A1 (0.51) | PTGS2PTGS1KDM4EMEN1KMT2A |
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-2010005783-A1 | PYRROLIDINYL AND PIPERIDINYL COMPOUNDS USEFUL AS NHE-1 INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-01-14 | — | — | WO | disclosed |