Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 6/20 | 0.58 |
| ▸ | TDO2 | P48775 | 3/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.51 |
| ▸ | RELA | Q04206 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | CCR1 | P32246 | 1/20 | 0.48 |
| ▸ | KLK7 | P49862 | 1/20 | 0.47 |
| ▸ | PRCP | P42785 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL20838737 | 1.00 | IDO1 (0.58) | IDO1TDO2CYP2C9CYP3A4CYP2C8 | |
| SCHEMBL17737538 | 1.00 | IDO1 (0.58) | IDO1TDO2CYP2C9CYP3A4CYP2C8 | |
| SCHEMBL20838754 | 0.90 | IDO1 (0.50) | IDO1TDO2CYP2C9CYP3A4CYP2C8 | |
| SCHEMBL17737122 | 0.87 | IDO1 (0.51) | IDO1TDO2CYP2C9CYP3A4CYP2C8 | |
| SCHEMBL20838723 | 0.87 | IDO1 (0.51) | IDO1TDO2CYP2C9CYP3A4CYP2C8 | |
| SCHEMBL17737121 | 0.87 | IDO1 (0.51) | IDO1TDO2CYP2C9CYP3A4CYP2C8 | |
| SCHEMBL20852663 | 0.87 | IDO1 (0.51) | IDO1TDO2CYP2C9CYP3A4CYP2C8 | |
| SCHEMBL20852664 | 0.85 | KLK7 (0.55) | IDO1TDO2CYP2C9CYP3A4CYP2C8 | |
| SCHEMBL20838715 | 0.85 | KLK7 (0.55) | IDO1TDO2CYP2C9CYP3A4CYP2C8 | |
| SCHEMBL17737525 | 0.85 | KLK7 (0.55) | IDO1TDO2CYP2C9CYP3A4CYP2C8 |
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-2016073738-A2 | IMMUNOREGULATORY AGENTS | FLEXUS BIOSCIENCES, INC. (US) | 2016-05-12 | — | — | WO | disclosed |