Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | CASP3 | P42574 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5737327 | 0.85 | HSD17B10 (0.37) | HSD17B10CYP3A4CYP2D6HSD11B1SMN1; SMN2 | |
| SCHEMBL7362291 | 0.75 | HSD17B10 (0.42) | HSD17B10CA1CA2CYP3A4CYP2D6 | |
| SCHEMBL12084380 | 0.75 | HSD17B10 (0.42) | HSD17B10CA1CA2CYP3A4CYP2D6 | |
| SCHEMBL17595517 | 0.70 | HPGD (0.41) | HSD17B10CYP3A4CYP2D6HPGDCASP3 | |
| SCHEMBL25730353 | 0.70 | HPGD (0.41) | HSD17B10CYP3A4CYP2D6HPGDCASP3 | |
| SCHEMBL17595518 | 0.70 | HPGD (0.41) | HSD17B10CYP3A4CYP2D6HPGDCASP3 | |
| SCHEMBL4590220 | 0.70 | HSD17B10 (0.54) | HSD17B10SMN1; SMN2NPC1LMNANPSR1 | |
| SCHEMBL15665375 | 0.69 | CYP3A4 (0.43) | HSD17B10CA1CA2CYP3A4CYP2D6 | |
| SCHEMBL5734517 | 0.69 | CYP3A4 (0.43) | HSD17B10CA1CA2CYP3A4CYP2D6 | |
| SCHEMBL3085529 | 0.69 | HPGD (0.47) | HSD17B10HPGDEPHX1 |
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 |