Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | CYP1A1 | P04798 | 6/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 6/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | TMIGD3 | P0DMS9 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2148915 | 0.82 | KDM4E (0.43) | CYP3A4KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL2149236 | 0.81 | CYSLTR1 (0.49) | CYP3A4KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL2529900 | 0.79 | CYP1A1 (0.43) | CYP3A4KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL28822758 | 0.78 | CYP1A2 (0.40) | CYP3A4KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL28036236 | 0.76 | CYP1A2 (0.55) | CYP3A4KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL15906681 | 0.75 | CYP1A1 (0.38) | CYP3A4KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL16741102 | 0.73 | KDM4E (0.47) | CYP3A4KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL2148858 | 0.72 | SMN1; SMN2 (0.47) | CYP3A4ALDH1A1MAPTCYP1A2TSHR | |
| SCHEMBL2149193 | 0.72 | CSNK2A2 (0.48) | KDM4EALDH1A1MAPTHSD17B10MEN1 | |
| SCHEMBL12220171 | 0.72 | GPR35 (0.44) | MEN1NPC1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-105198872-A | Chromenone analogs as sirtuin modulators | SIRTRIS PHARMACEUTICALS INC | 2015-12-30 | — | — | CN | disclosed |
| CN-102227417-B | Chromenone analogs as sirtuin modulators | SIRTRIS PHARMACEUTICALS, INC. (US) | 2015-09-16 | — | — | CN | disclosed |