Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.68 |
| ▸ | TDO2 | P48775 | 1/20 | 0.56 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17665350 | 0.88 | IDO1 (0.59) | IDO1TDO2TSHRHPGDALDH1A1 | |
| SCHEMBL17651949 | 0.81 | IDO1 (0.67) | IDO1TDO2GAA | |
| SCHEMBL20129573 | 0.81 | IDO1 (0.67) | IDO1TDO2ALDH1A1HSD17B10MEN1 | |
| SCHEMBL16135335 | 0.80 | IDO1 (0.98) | IDO1TDO2TSHRCYP3A4CYP2D6 | |
| SCHEMBL17665335 | 0.79 | TDO2 (0.59) | IDO1TDO2LMNA | |
| SCHEMBL17536832 | 0.78 | IDO1 (0.69) | IDO1TDO2ALDH1A1KDM4ECYP1A2 | |
| SCHEMBL16135366 | 0.76 | IDO1 (0.61) | IDO1TDO2HPGDALDH1A1LMNA | |
| SCHEMBL19825140 | 0.74 | TDO2 (0.54) | IDO1TDO2ALDH1A1KDM4ECYP1A2 | |
| SCHEMBL17651958 | 0.74 | TDO2 (0.63) | IDO1TDO2 | |
| SCHEMBL16135334 | 0.74 | IDO1 (0.78) | IDO1TDO2 |
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-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 |