Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.65 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.65 |
| ▸ | NPC1 | O15118 | 2/20 | 0.61 |
| ▸ | RAB9A | P51151 | 2/20 | 0.61 |
| ▸ | FAAH | O00519 | 1/20 | 0.56 |
| ▸ | GRIN2B | Q13224 | 10/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.52 |
| ▸ | TPSAB1 | Q15661 | 2/20 | 0.49 |
| ▸ | TPSD1 | Q9BZJ3 | 2/20 | 0.49 |
| ▸ | TPSG1 | Q9NRR2 | 2/20 | 0.49 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.49 |
| ▸ | F2 | P00734 | 1/20 | 0.48 |
| ▸ | PLG | P00747 | 1/20 | 0.48 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8553423 | 0.90 | SMN1; SMN2 (0.68) | SMN1; SMN2CYP2C19NPC1RAB9AFAAH | |
| SCHEMBL6823133 | 0.87 | SMN1; SMN2 (0.67) | SMN1; SMN2CYP2C19NPC1RAB9AFAAH | |
| SCHEMBL31597015 | 0.86 | SMN1; SMN2 (0.67) | SMN1; SMN2CYP2C19NPC1RAB9AFAAH | |
| SCHEMBL6948530 | 0.86 | SMN1; SMN2 (0.65) | SMN1; SMN2CYP2C19NPC1RAB9AFAAH | |
| SCHEMBL15140566 | 0.86 | SMN1; SMN2 (0.72) | SMN1; SMN2CYP2C19NPC1RAB9AFAAH | |
| SCHEMBL9216971 | 0.85 | SMN1; SMN2 (0.64) | SMN1; SMN2CYP2C19NPC1RAB9AFAAH | |
| SCHEMBL4364637 | 0.85 | SMN1; SMN2 (0.67) | SMN1; SMN2CYP2C19NPC1RAB9AFAAH | |
| SCHEMBL6948532 | 0.84 | SMN1; SMN2 (0.62) | SMN1; SMN2CYP2C19NPC1RAB9AFAAH | |
| SCHEMBL5763722 | 0.84 | BCHE (0.63) | SMN1; SMN2CYP2C19NPC1RAB9AFAAH | |
| Hydrochloric Acid SCHEMBL14157232 | 0.84 | SMN1; SMN2 (0.66) | SMN1; SMN2CYP2C19NPC1RAB9AFAAH |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5817677-A | ANTITHROMBOSIS AGENTS | DR. KARL THOMAE GMBH (DE) | 1998-10-06 | — | — | US | disclosed |
| EP-0858457-A1 | 5-MEMBERED HETEROCYCLES, PHARMACEUTICAL AGENTS CONTAINING SAID COMPOUNDS AND THE USE THEREOF AND METHODS OF PRODUCING THEM | Dr. Karl Thomae GmbH (DE) | 1998-08-19 | — | — | EP | disclosed |
| WO-1997015567-A1 | 5-MEMBERED HETEROCYCLES, PHARMACEUTICAL AGENTS CONTAINING SAID COMPOUNDS AND THE USE THEREOF AND METHODS OF PRODUCING THEM | DR. KARL THOMAE GMBH (DE) | 1997-05-01 | — | — | WO | disclosed |