Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | MGAM | O43451 | 1/20 | 0.35 |
| ▸ | SI | P14410 | 1/20 | 0.35 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14529245 | 0.76 | PRKCI (0.47) | ALDH1A1MAPT | |
| SCHEMBL30951612 | 0.71 | ALDH1A1 (0.54) | ALDH1A1KMT2AMEN1KDM4ETSHR | |
| SCHEMBL29254490 | 0.71 | ALDH1A1 (0.54) | ALDH1A1KMT2AMEN1KDM4ETSHR | |
| SCHEMBL23149729 | 0.70 | PARP10 (0.53) | ALDH1A1KMT2AMEN1KDM4ECYP1A2 | |
| SCHEMBL8600414 | 0.70 | LMNA (0.62) | ALDH1A1KMT2AMEN1KDM4ECYP1A2 | |
| SCHEMBL572 | 0.69 | KMT2A (0.58) | ALDH1A1KMT2AMEN1KDM4ETSHR | |
| SCHEMBL2459917 | 0.69 | ALDH1A1 (0.51) | ALDH1A1KMT2AMEN1KDM4ETSHR | |
| SCHEMBL1348885 | 0.69 | KDM4E (0.51) | ALDH1A1KMT2AMEN1KDM4ETSHR | |
| SCHEMBL30955356 | 0.69 | ALDH1A1 (0.51) | ALDH1A1KMT2AMEN1KDM4ETSHR | |
| SCHEMBL19987556 | 0.69 | KMT2A (0.51) | ALDH1A1KMT2AMEN1KDM4ETSHR |
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-2012149157-A2 | HETEROCYCLIC COMPOUNDS FOR THE INHIBITION OF PASK | BIOENERGENIX (US) | 2012-11-01 | — | — | WO | disclosed |