Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.37 |
| ▸ | CYP2A13 | Q16696 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 3/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | PNMT | P11086 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1907932 | 0.86 | TAAR1 (0.35) | TAAR1CYP2A13HTTGLANPSR1 | |
| SCHEMBL2778676 | 0.86 | ALDH1A1 (0.39) | GLAALDH1A1TP53CYP3A4TSHR | |
| SCHEMBL3534749 | 0.82 | TAAR1 (0.51) | TAAR1CYP2A13HTTPNMTALDH1A1 | |
| SCHEMBL31076452 | 0.80 | TAAR1 (0.36) | TAAR1CYP2A13HTTPNMTALDH1A1 | |
| SCHEMBL13116361 | 0.80 | HSP90AA1 (0.45) | TAAR1CYP2A13PNMTALDH1A1TP53 | |
| SCHEMBL1944225 | 0.80 | TAAR1 (0.50) | TAAR1CYP2A13HTTNPSR1ALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL1411992 | 0.79 | ALDH1A1 (0.35) | GLAALDH1A1TP53CYP3A4TSHR | |
| SCHEMBL3117388 | 0.79 | ALDH1A1 (0.41) | TAAR1CYP2A13GLAALDH1A1TP53 | |
| SCHEMBL9471583 | 0.78 | ALDH1A1 (0.34) | ALDH1A1TP53CYP3A4TSHRSMN1; SMN2 | |
| SCHEMBL21359692 | 0.78 | PNMT (0.35) | PNMTALDH1A1TP53CYP3A4TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-104903359-B | Method for forming polymerization catalysts with controlled catalyst properties and use thereof in olefin polymerization | 格雷斯公司 | 2018-05-08 | — | — | CN | disclosed |