Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | GMNN | O75496 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | THPO | P40225 | 1/20 | 0.32 |
| ▸ | MTOR | P42345 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CETP | P11597 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | UBE2N | P61088 | 1/20 | 0.32 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20779254 | 0.79 | DNM1 (0.32) | SPHK1DNM1CA2MAPK1CTSK | |
| SCHEMBL20779495 | 0.76 | ALDH1A1 (0.42) | ALDH1A1SPHK1LMNATSHRCYP2D6 | |
| SCHEMBL29088230 | 0.73 | DNM1 (0.38) | ALDH1A1LMNATSHRCYP3A4DNM1 | |
| SCHEMBL20779267 | 0.72 | MAPT (0.35) | ALDH1A1LMNACYP2D6POLBKDM4E | |
| SCHEMBL14567279 | 0.71 | CA2 (0.37) | ALDH1A1SPHK1TSHRDNM1CA2 | |
| SCHEMBL30940110 | 0.70 | ALDH1A1 (0.43) | ALDH1A1SPHK1LMNATSHRCYP2D6 | |
| SCHEMBL11145481 | 0.70 | TDP1 (0.39) | ALDH1A1LMNATSHR | |
| SCHEMBL5873440 | 0.70 | TDP1 (0.39) | ALDH1A1LMNATSHR | |
| SCHEMBL21823199 | 0.68 | FDPS (0.38) | SPHK1LMNACYP2D6GMNNPOLB | |
| SCHEMBL10756537 | 0.68 | TDP1 (0.40) | ALDH1A1LMNATSHR |
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-2019046271-A1 | HEPATITIS B ANTIVIRAL AGENTS | ENANTA PHARMACEUTICALS, INC. (US) | 2019-03-07 | — | — | WO | disclosed |