Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27576865 | 0.81 | ALDH1A1 (0.44) | SMN1; SMN2KMT2AMEN1TSHRALDH1A1 | |
| SCHEMBL8021970 | 0.77 | ALDH1A1 (0.42) | SMN1; SMN2KMT2ACYP2C19MEN1CYP3A4 | |
| SCHEMBL5089520 | 0.77 | ALDH1A1 (0.42) | SMN1; SMN2KMT2ACYP2C19MEN1CYP3A4 | |
| SCHEMBL5370663 | 0.76 | ALDH1A1 (0.43) | KMT2ATSHRALDH1A1RAB9ANPC1 | |
| SCHEMBL28961752 | 0.74 | ALDH1A1 (0.40) | SMN1; SMN2KMT2ACYP2C19MEN1CYP3A4 | |
| SCHEMBL9417494 | 0.73 | PLA2G2A (0.50) | SMN1; SMN2KMT2AMEN1CYP3A4TSHR | |
| SCHEMBL9417618 | 0.73 | PLA2G2A (0.50) | SMN1; SMN2KMT2AMEN1CYP3A4TSHR | |
| SCHEMBL10779297 | 0.72 | ALDH1A1 (0.41) | SMN1; SMN2TSHRALDH1A1GLALMNA | |
| SCHEMBL26670322 | 0.72 | TDP1 (0.44) | SMN1; SMN2KMT2ATSHRALDH1A1NPSR1 | |
| Ethylamine SCHEMBL28630883 | 0.71 | TSHR (0.42) | SMN1; SMN2KMT2AMEN1TSHRALDH1A1 |
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-2012048013-A2 | PHOSPHORODIAMIDATE DERIVATIVES OF GUANOSINE NUCLEOSIDE COMPOUNDS FOR TREATMENT OF VIRAL INJECTIONS | INHIBITEX, INC. (US) | 2012-04-12 | — | — | WO | disclosed |