Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 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 | |
|---|---|---|---|---|
| SCHEMBL19995849 | 0.78 | ALDH1A1 (0.36) | ALDH1A1TP53CYP3A4TSHRTDP1 | |
| SCHEMBL30973444 | 0.78 | ALDH1A1 (0.36) | ALDH1A1TP53CYP3A4TSHRTDP1 | |
| SCHEMBL21892900 | 0.75 | DRD2 (0.31) | — | |
| SCHEMBL10277460 | 0.73 | NOS3 (0.39) | ALDH1A1TP53CYP3A4TSHRTDP1 | |
| SCHEMBL21892964 | 0.71 | MAPT (0.41) | ALDH1A1 | |
| SCHEMBL5155574 | 0.71 | MEN1 (0.43) | ALDH1A1TP53CYP3A4TSHRTDP1 | |
| SCHEMBL2492885 | 0.71 | HSD17B10 (0.36) | ALDH1A1TP53CYP3A4TSHRTDP1 | |
| SCHEMBL23607595 | 0.71 | ALDH1A1 (0.48) | ALDH1A1TSHRNOS3NOS1NOS2 | |
| SCHEMBL19995818 | 0.71 | NOS3 (0.35) | ALDH1A1NOS3NOS1NOS2 | |
| SCHEMBL20726536 | 0.70 | ALDH1A1 (0.38) | ALDH1A1TSHRNOS3NOS1NOS2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019183145-A1 | COMPOUNDS AND METHODS FOR IDO AND TDO MODULATION, AND INDICATIONS THEREFOR | PLEXXIKON INC. (US) | 2019-09-26 | — | — | WO | disclosed |
| WO-2018057973-A1 | COMPOUNDS AND METHODS FOR IDO AND TDO MODULATION, AND INDICATIONS THEREFOR | PLEXXIKON INC. (US) | 2018-03-29 | — | — | WO | disclosed |