Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | ERN1 | O75460 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 2/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7064896 | 0.83 | ESR1 (0.43) | TSHRHPGDALDH1A1LMNAMAPT | |
| SCHEMBL1883040 | 0.75 | MAPT (0.49) | CYP3A4TSHRSMN1; SMN2KMT2AALDH1A1 | |
| SCHEMBL11367351 | 0.75 | BACE1 (0.49) | CYP3A4KMT2AALDH1A1LMNAMAPT | |
| SCHEMBL30029048 | 0.75 | ALDH1A1 (0.40) | CYP3A4TSHRTP53HPGDSMN1; SMN2 | |
| SCHEMBL27462702 | 0.75 | MAPT (0.43) | CYP3A4TSHRKMT2AALDH1A1LMNA | |
| SCHEMBL27376059 | 0.74 | GPR35 (0.57) | CYP3A4TSHRTP53HPGDSMN1; SMN2 | |
| SCHEMBL27607677 | 0.74 | MEN1 (0.45) | CYP3A4TSHRTP53HPGDSMN1; SMN2 | |
| SCHEMBL4750554 | 0.73 | DGAT1 (0.41) | TSHRHPGDALDH1A1MAPTERN1 | |
| SCHEMBL299878 | 0.73 | FBP1 (0.49) | CYP3A4TSHRTP53ALDH1A1PARP1 | |
| SCHEMBL27271193 | 0.73 | ALDH1A1 (0.47) | CYP3A4TSHRSMN1; SMN2KMT2AALDH1A1 |
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-2008130571-A1 | NUCLEAR RECEPTOR BINDING AGENTS | GTX, INC. (US) | 2008-10-30 | — | — | WO | disclosed |