Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | CXCR3 | P49682 | 7/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17627703 | 0.95 | KCNH2 (0.55) | KCNH2TDP1TSHRKDM4EHTT | |
| SCHEMBL4933865 | 0.95 | KCNH2 (0.55) | KCNH2TDP1TSHRKDM4EHTT | |
| SCHEMBL1866120 | 0.95 | KCNH2 (0.55) | KCNH2TDP1TSHRKDM4EHTT | |
| SCHEMBL9723550 | 0.95 | KCNH2 (0.55) | KCNH2TDP1TSHRKDM4EHTT | |
| SCHEMBL132597 | 0.95 | KCNH2 (0.55) | KCNH2TDP1TSHRKDM4EHTT | |
| SCHEMBL17627701 | 0.95 | KCNH2 (0.55) | KCNH2TDP1TSHRKDM4EHTT | |
| Acetic Acid SCHEMBL14763969 | 0.92 | KCNH2 (0.53) | KCNH2TDP1TSHRKDM4EHTT | |
| Acetic Acid SCHEMBL15140921 | 0.92 | KCNH2 (0.53) | KCNH2TDP1TSHRKDM4EHTT | |
| SCHEMBL930939 | 0.85 | KCNH2 (0.47) | KCNH2TDP1TSHRKDM4EHTT | |
| Nopol SCHEMBL17187721 | 0.85 | TSHR (0.55) | KCNH2TDP1TSHRKDM4EHTT |
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-6444637-B1 | FORMING ALDEHYDE BY LEWIS ACID-CATALYZED REACTION OF ALKENE WITH EPOXIDE | QUEST INTERNATIONAL B.V. (NL) | 2002-09-03 | — | — | US | disclosed |