Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 6/20 | 0.67 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.46 |
| ▸ | CTSG | P08311 | 1/20 | 0.46 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.46 |
| ▸ | CMA1 | P23946 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11198672 | 0.90 | EPHX2 (0.55) | EPHX2CYP2C9CYP2C19SMN1; SMN2NPC1 | |
| SCHEMBL11195201 | 0.87 | EPHX2 (0.55) | EPHX2CYP2C9CYP2C19SMN1; SMN2NPC1 | |
| SCHEMBL11198968 | 0.87 | CASR (0.56) | EPHX2CYP2C9CYP2C19SMN1; SMN2NPC1 | |
| SCHEMBL7093337 | 0.84 | NPC1 (0.61) | EPHX2CYP2C9CYP2C19SMN1; SMN2NPC1 | |
| SCHEMBL11192559 | 0.83 | MTNR1A (0.66) | EPHX2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL11197819 | 0.83 | NAAA (0.52) | EPHX2SMN1; SMN2NPC1RAB9AKMT2A | |
| SCHEMBL11195120 | 0.82 | RAB9A (0.61) | CYP2C9CYP2C19SMN1; SMN2NPC1RAB9A | |
| SCHEMBL11195091 | 0.82 | EPHX2 (0.58) | EPHX2CYP2C9CYP2C19SMN1; SMN2NPC1 | |
| SCHEMBL11200284 | 0.82 | ALDH1A1 (0.50) | EPHX2SMN1; SMN2NPC1RAB9ANPSR1 | |
| SCHEMBL11198243 | 0.81 | NPC1 (0.60) | SMN1; SMN2NPC1RAB9APOLBGAA |
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-4379926-A | DIURETICS | AYERST, MCKENNA & HARRISON LTD. (CA) | 1983-04-12 | — | — | US | disclosed |