Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.30 |
| ▸ | TSHR | P16473 | 2/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.30 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.30 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.30 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.30 |
| ▸ | PGR | P06401 | 1/20 | 0.30 |
| ▸ | AR | P10275 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28198519 | 0.81 | ALDH1A1 (0.36) | SMN1; SMN2ALDH1A1LMNATP53MAPK1 | |
| SCHEMBL20658012 | 0.77 | SMN1; SMN2 (0.36) | SMN1; SMN2MAPTALDH1A1NPSR1 | |
| SCHEMBL8744673 | 0.76 | TSHR (0.39) | SMN1; SMN2ALDH1A1LMNATSHR | |
| SCHEMBL8091709 | 0.73 | CYP1A2 (0.33) | — | |
| SCHEMBL27704529 | 0.71 | SMN1; SMN2 (0.35) | SMN1; SMN2MAPTALDH1A1NPSR1 | |
| SCHEMBL1082427 | 0.71 | CYP19A1 (0.35) | CYP19A1ALDH1A1 | |
| SCHEMBL13883184 | 0.70 | CYP19A1 (0.33) | CYP19A1 | |
| SCHEMBL38652270 | 0.70 | SMN1; SMN2 (0.34) | SMN1; SMN2CYP19A1MAPTALDH1A1MAPK1 | |
| SCHEMBL10451200 | 0.69 | MEN1 (0.31) | CYP19A1MAPT | |
| SCHEMBL10450835 | 0.69 | MEN1 (0.31) | CYP19A1MAPT |
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-105143212-A | Tripeptide epoxy ketone protease inhibitors | ONYX THERAPEUTICS INC | 2015-12-09 | — | — | CN | disclosed |