Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL18850986 | 0.94 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2POLBTDP1CYP2C19 | |
| SCHEMBL18851213 | 0.89 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2POLBTDP1CYP2C19 | |
| SCHEMBL18851457 | 0.85 | SMN1; SMN2 (0.46) | ALDH1A1SMN1; SMN2POLBCYP2C19NPSR1 | |
| SCHEMBL18824227 | 0.82 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2POLBTDP1CYP2C19 | |
| SCHEMBL13306274 | 0.81 | — | — | |
| SCHEMBL4781902 | 0.81 | NPSR1 (0.60) | ALDH1A1SMN1; SMN2TDP1CYP2C19NPSR1 | |
| SCHEMBL8159848 | 0.80 | TDP1 (0.54) | ALDH1A1SMN1; SMN2POLBTDP1CYP2C19 | |
| SCHEMBL24260095 | 0.80 | TSHR (0.46) | ALDH1A1SMN1; SMN2POLBCYP2C19KMT2A | |
| SCHEMBL861660 | 0.80 | CYP2C19 (0.53) | SMN1; SMN2TDP1CYP2C19NPSR1KMT2A | |
| SCHEMBL18851458 | 0.78 | CYP2C19 (0.42) | ALDH1A1SMN1; SMN2POLBCYP2C19NPSR1 |
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-2008119741-A2 | 3-IMIDAZOLYL-INDOLES FOR THE TREATMENT OF PROLIFERATIVE DISEASES | NOVARTIS AG (CH) | 2008-10-09 | — | — | WO | disclosed |