Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | KEAP1 | Q14145 | 3/20 | 0.48 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.48 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.42 |
| ▸ | RORC | P51449 | 1/20 | 0.41 |
| ▸ | CCR2 | P41597 | 1/20 | 0.41 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 2/20 | 0.41 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.41 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.41 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.41 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.41 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.41 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.41 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL8989867 | 0.84 | PKM (0.70) | MCOLN3PKMKEAP1NFE2L2HCRTR2 | |
| SCHEMBL8989902 | 0.81 | MCOLN3 (0.51) | MCOLN3PKMKEAP1NFE2L2ALDH1A1 | |
| SCHEMBL8989994 | 0.79 | MCOLN3 (0.48) | MCOLN3PKMKEAP1NFE2L2ALDH1A1 | |
| SCHEMBL8989938 | 0.78 | PKM (0.50) | MCOLN3PKMKEAP1NFE2L2ALDH1A1 | |
| SCHEMBL8989915 | 0.78 | C5AR1 (0.51) | MCOLN3KEAP1NFE2L2ALDH1A1PTGER1 | |
| SCHEMBL8989884 | 0.77 | ALDH1A1 (0.47) | MCOLN3PKMALDH1A1MAPTGABRP | |
| SCHEMBL3249396 | 0.76 | PKM (0.51) | MCOLN3PKMKEAP1NFE2L2HCRTR2 | |
| SCHEMBL8989945 | 0.76 | C5AR1 (0.56) | MCOLN3KEAP1NFE2L2HCRTR2PTGER1 | |
| SCHEMBL8989874 | 0.75 | PKM (0.56) | MCOLN3PKMKEAP1NFE2L2HCRTR2 | |
| SCHEMBL8989935 | 0.74 | LMNA (0.56) | CCR2MAPTTP53GABRPGABRD |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5578633-A | VASOPRESSIN AND OXYTOCIN ANTAGONISTS | SANOFI (FR) | 1996-11-26 | — | — | US | disclosed |
| US-5481005-A | N-sulfonylindoline derivatives, their preparation and the pharmaceutical compositions in which they are present | SANOFI (FR) | 1996-01-02 | — | — | US | disclosed |
| US-5397801-A | Affinity for vasopressin and ocytocin receptors; disorders of nervous, cardiovascular and gastrointestinal systems | SANOFI (FR) | 1995-03-14 | — | — | US | disclosed |
| US-5338755-A | Have affinity for vasopressin and ocytocin receptors; intermediates for drugs that act on central nervous system | ELF SANOFI (FR) | 1994-08-16 | — | — | US | disclosed |