Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNQ4 | P56696 | 3/20 | 0.39 |
| ▸ | KCNQ5 | Q9NR82 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | MMP1 | P03956 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | MMP8 | P22894 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
| ▸ | CISD2 | Q8N5K1 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL23093142 | 0.83 | SMN1; SMN2 (0.47) | KCNQ4KCNQ5SMN1; SMN2TP53TSHR | |
| SCHEMBL23093086 | 0.83 | SMN1; SMN2 (0.43) | KCNQ4KCNQ5SMN1; SMN2TP53TSHR | |
| SCHEMBL23092995 | 0.82 | SMN1; SMN2 (0.43) | KCNQ4KCNQ5SMN1; SMN2TP53TSHR | |
| SCHEMBL23092969 | 0.82 | SMN1; SMN2 (0.46) | KCNQ4KCNQ5SMN1; SMN2TP53TSHR | |
| SCHEMBL5390555 | 0.82 | CYP17A1 (0.49) | SMN1; SMN2POLBCA1CA2MMP1 | |
| SCHEMBL7986249 | 0.81 | CYP3A4 (0.44) | SMN1; SMN2CA1CA2MMP1MMP2 | |
| SCHEMBL5162892 | 0.78 | SMN1; SMN2 (0.48) | KCNQ4KCNQ5SMN1; SMN2NR1H4MAPT | |
| SCHEMBL23093006 | 0.77 | SMN1; SMN2 (0.41) | KCNQ4KCNQ5SMN1; SMN2TP53TSHR | |
| SCHEMBL6676620 | 0.76 | SMN1; SMN2 (0.47) | KCNQ4KCNQ5SMN1; SMN2NR1H4MAPT | |
| SCHEMBL21799295 | 0.76 | CA12 (0.47) | KCNQ4KCNQ5CA1CA2CA12 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021050547-A1 | MITOCHONDRIAL COMPLEX I INHIBITORS AND METHODS OF USE | Sanford Burnham Prebys Medical Discovery Institute (US) | 2021-03-18 | — | — | WO | disclosed |