Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | KCNQ4 | P56696 | 3/20 | 0.37 |
| ▸ | KCNQ5 | Q9NR82 | 3/20 | 0.37 |
| ▸ | CISD2 | Q8N5K1 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL23093086 | 0.83 | SMN1; SMN2 (0.43) | SMN1; SMN2TP53TSHRMEN1KMT2A | |
| SCHEMBL23093142 | 0.83 | SMN1; SMN2 (0.47) | SMN1; SMN2TP53TSHRMEN1KMT2A | |
| SCHEMBL23092969 | 0.82 | SMN1; SMN2 (0.46) | SMN1; SMN2TP53TSHRMEN1KMT2A | |
| SCHEMBL23092995 | 0.82 | SMN1; SMN2 (0.43) | SMN1; SMN2TP53TSHRMEN1KMT2A | |
| SCHEMBL5162892 | 0.78 | SMN1; SMN2 (0.48) | SMN1; SMN2MEN1KMT2AMAPTPOLB | |
| SCHEMBL23093001 | 0.77 | KCNQ4 (0.39) | SMN1; SMN2TP53TSHRMEN1KMT2A | |
| SCHEMBL6676620 | 0.76 | SMN1; SMN2 (0.47) | SMN1; SMN2MEN1KMT2AMAPTPOLB | |
| SCHEMBL8297312 | 0.76 | SMN1; SMN2 (0.63) | SMN1; SMN2TP53MEN1KMT2AMAPT | |
| SCHEMBL24723482 | 0.74 | CYP17A1 (0.51) | — | |
| SCHEMBL14088041 | 0.74 | AAK1 (0.41) | SMN1; SMN2CYP1A2CYP2C9CYP2C19HPGD |
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 |