Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 5/20 | 0.53 |
| ▸ | MASP2 | O00187 | 1/20 | 0.48 |
| ▸ | F2 | P00734 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 5/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.44 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.44 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | HSPB1 | P04792 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | AR | P10275 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27724481 | 0.87 | ALDH1A1 (0.53) | KIF11MASP2F2TDP1ALDH1A1 | |
| SCHEMBL27741538 | 0.82 | KIF11 (0.48) | KIF11MASP2F2TDP1ALDH1A1 | |
| SCHEMBL27717188 | 0.81 | MAPT (0.55) | KIF11MASP2F2TDP1ALDH1A1 | |
| SCHEMBL27719575 | 0.81 | HSPB1 (0.50) | KIF11MASP2F2TDP1ALDH1A1 | |
| SCHEMBL27718299 | 0.81 | HSPB1 (0.50) | KIF11MASP2F2TDP1ALDH1A1 | |
| SCHEMBL27752566 | 0.81 | ALDH1A1 (0.53) | KIF11MASP2F2TDP1ALDH1A1 | |
| SCHEMBL27739955 | 0.81 | MAPT (0.60) | KIF11TDP1ALDH1A1MAPTPOLB | |
| SCHEMBL28775045 | 0.80 | KIF11 (0.56) | KIF11MASP2F2TDP1ALDH1A1 | |
| SCHEMBL27723696 | 0.79 | ALDH1A1 (0.50) | KIF11MASP2F2TDP1ALDH1A1 | |
| SCHEMBL11814312 | 0.78 | ALDH1A1 (0.63) | KIF11TDP1ALDH1A1MAPTPOLB |
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-101397253-A | Method for preparing 3,3-dinitro-4,4-bis(2,6-dinitro-4-trifluoromethyl phenoxy) biphenyl | UNIV DONGHUA (CN) | 2009-04-01 | — | — | CN | disclosed |
| CN-101265192-A | Method for preparing 4,4'-di(2,6-dinitro-4-trifluoromethylphenoxy)biphenyl | UNIV DONGHUA (CN) | 2008-09-17 | — | — | CN | disclosed |