Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.41 |
| ▸ | CUL4A | Q13619 | 1/20 | 0.35 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.35 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.35 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL186269 | 0.83 | ALDH1A1 (0.50) | ALDH1A1KDM4EHPGDHSD17B10TRPV4 | |
| Cyanide SCHEMBL28871133 | 0.78 | ALDH1A1 (0.47) | ALDH1A1KDM4EHPGDHSD17B10TRPV4 | |
| SCHEMBL19062287 | 0.76 | ALDH1A1 (0.46) | ALDH1A1KDM4EHPGDHSD17B10TRPV4 | |
| SCHEMBL186554 | 0.74 | KDM4E (0.44) | ALDH1A1KDM4EHPGDHSD17B10TRPV4 | |
| SCHEMBL186023 | 0.73 | KDM4E (0.47) | ALDH1A1KDM4EHPGDHSD17B10TAS1R3 | |
| SCHEMBL421862 | 0.73 | ALDH1A1 (0.43) | ALDH1A1KDM4EHPGDHSD17B10TRPV4 | |
| SCHEMBL286715 | 0.73 | CYP1A2 (0.50) | ALDH1A1KDM4EHPGDHSD17B10TRPV4 | |
| SCHEMBL3154084 | 0.73 | ALDH1A1 (0.43) | ALDH1A1KDM4EHPGDHSD17B10TRPV4 | |
| SCHEMBL525892 | 0.73 | ALDH1A1 (0.43) | ALDH1A1KDM4EHPGDHSD17B10TRPV4 | |
| SCHEMBL29555331 | 0.73 | KDM4E (0.43) | ALDH1A1KDM4EHPGDHSD17B10TRPV4 |
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-2018089493-A1 | PYRROLE mTORC INHIBITORS AND USES THEREOF | NAVITOR PHARMACEUTICALS, INC. (US) | 2018-05-17 | — | — | WO | disclosed |