Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDO2 | P48775 | 7/20 | 0.62 |
| ▸ | IDO1 | P14902 | 9/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.31 |
| ▸ | GABRB3 | P28472 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18157867 | 0.80 | TDO2 (0.56) | TDO2IDO1CYP3A4HCAR1ACHE | |
| SCHEMBL17651965 | 0.80 | TDO2 (0.56) | TDO2IDO1CYP3A4HCAR1ACHE | |
| SCHEMBL17665340 | 0.78 | TDO2 (0.55) | TDO2IDO1CYP3A4ACHEHSP90AA1 | |
| SCHEMBL17651989 | 0.77 | TDO2 (1.00) | TDO2IDO1CYP3A4ACHE | |
| SCHEMBL17665341 | 0.76 | TDO2 (0.52) | TDO2IDO1CYP3A4HCAR1ACHE | |
| SCHEMBL20129559 | 0.76 | TDO2 (0.52) | TDO2IDO1CYP3A4HCAR1ACHE | |
| SCHEMBL17651949 | 0.75 | IDO1 (0.67) | TDO2IDO1 | |
| SCHEMBL20129573 | 0.75 | IDO1 (0.67) | TDO2IDO1 | |
| SCHEMBL17665688 | 0.75 | TDO2 (0.58) | TDO2IDO1CYP3A4ACHE | |
| SCHEMBL20129574 | 0.74 | TDO2 (0.64) | TDO2IDO1CYP3A4HSP90AA1HSP90AB1 |
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-2016051181-A1 | 4H-IMIDAZO[1,5-A]INDOLE DERIVATIVES AND THEIR USE AS INDOLEAMINE 2,3-DIOXYGENASE (IDO) AND/OR TRYPTOPHAN 2,3-DIOXYGENASE (TD02) MODULATORS | REDX PHARMA PLC (GB) | 2016-04-07 | — | — | WO | disclosed |
| WO-2016051181-A1 | 4H-IMIDAZO[1,5-A]INDOLE DERIVATIVES AND THEIR USE AS INDOLEAMINE 2,3-DIOXYGENASE (IDO) AND/OR TRYPTOPHAN 2,3-DIOXYGENASE (TD02) MODULATORS | REDX PHARMA PLC (GB) | 2016-04-07 | — | — | WO | disclosed |