Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.53 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.53 |
| ▸ | AKR1C3 | P42330 | 5/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | BMP1 | P13497 | 1/20 | 0.41 |
| ▸ | LDHA | P00338 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CDC42 | P60953 | 1/20 | 0.40 |
| ▸ | RAC1 | P63000 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA7 | P43166 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL490403 | 0.84 | PTGS2 (0.51) | PTGS2PTGS1AKR1C3AKR1C2KMT2A | |
| SCHEMBL5741476 | 0.84 | TSHR (0.46) | PTGS2PTGS1KMT2ABMP1LDHA | |
| SCHEMBL3954798 | 0.84 | PTGS2 (0.55) | PTGS2PTGS1AKR1C3AKR1C2KMT2A | |
| SCHEMBL5905603 | 0.79 | AOC3 (0.40) | KMT2ABMP1TSHRCA1CA2 | |
| SCHEMBL12552006 | 0.78 | CA1 (0.44) | KMT2AKDM4ETSHRMAPTCA1 | |
| SCHEMBL11793136 | 0.77 | PTGS1 (0.56) | PTGS2PTGS1AKR1C3AKR1C2KMT2A | |
| SCHEMBL8473051 | 0.77 | PTGS2 (0.64) | PTGS2PTGS1AKR1C3AKR1C2KMT2A | |
| SCHEMBL15211635 | 0.77 | PTGS1 (0.43) | PTGS2PTGS1AKR1C3AKR1C2KMT2A | |
| SCHEMBL7885098 | 0.77 | PTGS2 (0.64) | PTGS2PTGS1AKR1C3AKR1C2KMT2A | |
| SCHEMBL362211 | 0.77 | PTGS2 (0.64) | PTGS2PTGS1AKR1C3AKR1C2KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-7923573-B2 | Benzene compound having 2 or more substituents | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2011-04-12 | — | — | US | disclosed |