Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | ELANE | P08246 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | BLM | P54132 | 1/20 | 0.30 |
| ▸ | WRN | Q14191 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27718896 | 0.78 | CYP4F2 (0.44) | ALDH1A1MAPTKDM4EHSD17B10CYP1A2 | |
| SCHEMBL27513321 | 0.73 | NLRP3 (0.39) | NLRP3MAPT | |
| SCHEMBL18196041 | 0.69 | NLRP3 (0.43) | NLRP3ALDH1A1ELANEMAPTKDM4E | |
| SCHEMBL28322692 | 0.69 | TSHR (0.42) | ALDH1A1MAPTHSD17B10HPGD | |
| SCHEMBL27678643 | 0.69 | NLRP3 (0.35) | NLRP3ALDH1A1 | |
| SCHEMBL28992199 | 0.67 | DGKA (0.41) | NLRP3ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL9129929 | 0.64 | ALDH1A1 (0.43) | NLRP3ALDH1A1ELANEMAPT | |
| SCHEMBL11615588 | 0.64 | TP53 (0.48) | ALDH1A1KDM4EHIF1A | |
| SCHEMBL15128278 | 0.64 | NLRP3 (0.38) | NLRP3ALDH1A1ELANEMAPTCYP1A2 | |
| SCHEMBL1870004 | 0.62 | ALDH1A1 (0.63) | ALDH1A1MAPTHPGDCYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101479241-A | Pyrrole derivatives and their methods of use | ABBOTT LAB (US) | 2009-07-08 | — | — | CN | disclosed |