Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | MAOA | P21397 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.35 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | NQO1 | P15559 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14620260 | 0.69 | CYP1B1 (0.39) | ALDH1A1KDM4EHSD17B10HIF1AHPGD | |
| SCHEMBL7905250 | 0.67 | ALDH1A1 (0.60) | ALDH1A1MAOAHSD17B10HIF1AHPGD | |
| SCHEMBL29637136 | 0.67 | ALDH1A1 (0.60) | ALDH1A1MAOAHSD17B10HIF1AHPGD | |
| SCHEMBL17487162 | 0.66 | ALDH1A1 (0.58) | ALDH1A1MAOAMAOBKDM4EGAA | |
| SCHEMBL10073566 | 0.65 | MAPT (0.32) | KDM4EHSD17B10MAPK1 | |
| SCHEMBL7988846 | 0.65 | ALDH1A1 (0.58) | ALDH1A1KDM4EGAAHSD17B10HIF1A | |
| SCHEMBL4442152 | 0.64 | ALDH1A1 (0.55) | ALDH1A1MAOAHSD17B10HIF1AHPGD | |
| SCHEMBL10086973 | 0.64 | CYP1B1 (0.42) | ALDH1A1KDM4EGAAHSD17B10HIF1A | |
| SCHEMBL8735650 | 0.63 | CYP1A2 (0.44) | ALDH1A1KDM4EGAAHSD17B10HPGD | |
| SCHEMBL14641977 | 0.62 | CYP1A2 (0.52) | ALDH1A1KDM4EGAAHSD17B10HIF1A |
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-2007003520-A1 | FLUORESCENT DIKETOPYRROLOPYRROLES AND DERIVATIVES | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2007-01-11 | — | — | WO | disclosed |